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Azoles

Organic compounds that consist of five-membered heterocyclic molecules containing a nitrogen atom and at least one other non-carbon atom as part of the ring.
Imidazoles (909)
Oxazoles (2)
Pyrazoles (3)
Triazoles (4)

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1 – 15 of 278 results
2

1-Methylimidazole, 99%

CAS: 616-47-7 Molecular Formula: C4H6N2 Molecular Weight (g/mol): 82.11 MDL Number: MFCD00005292 InChI Key: MCTWTZJPVLRJOU-UHFFFAOYSA-N Synonym: 1-methyl-1h-imidazole,n-methylimidazole,1h-imidazole, 1-methyl,imidazole, 1-methyl,n-methyl imidazole,1-methyl-imidazole,unii-p4617qs63y,1-methyl-1h-imidazol,n-methylimidazol,1-methylimdazole PubChem CID: 1390 ChEBI: CHEBI:113454 IUPAC Name: 1-methylimidazole SMILES: CN1C=CN=C1

PubChem CID 1390
CAS 616-47-7
Molecular Weight (g/mol) 82.11
ChEBI CHEBI:113454
MDL Number MFCD00005292
SMILES CN1C=CN=C1
Synonym 1-methyl-1h-imidazole,n-methylimidazole,1h-imidazole, 1-methyl,imidazole, 1-methyl,n-methyl imidazole,1-methyl-imidazole,unii-p4617qs63y,1-methyl-1h-imidazol,n-methylimidazol,1-methylimdazole
IUPAC Name 1-methylimidazole
InChI Key MCTWTZJPVLRJOU-UHFFFAOYSA-N
Molecular Formula C4H6N2
3

1-Ethyl-3-methylimidazolium dicyanamide, 98%

CAS: 370865-89-7 Molecular Formula: C8H11N5 Molecular Weight (g/mol): 177.211 MDL Number: MFCD08276373 InChI Key: MKHFCTXNDRMIDR-UHFFFAOYSA-N Synonym: 1-ethyl-3-methylimidazolium dicyanamide,ethylmethylimidazolium dicyanamide,emim dca,acmc-209iqn,basionics™ vs 03,dsstox_cid_27940,dsstox_rid_82692,dsstox_gsid_47964,ksc221g0h PubChem CID: 11159638 IUPAC Name: cyanoiminomethylideneazanide;1-ethyl-3-methylimidazol-3-ium SMILES: CCN1C=C[N+](=C1)C.C(=[N-])=NC#N

PubChem CID 11159638
CAS 370865-89-7
Molecular Weight (g/mol) 177.211
MDL Number MFCD08276373
SMILES CCN1C=C[N+](=C1)C.C(=[N-])=NC#N
Synonym 1-ethyl-3-methylimidazolium dicyanamide,ethylmethylimidazolium dicyanamide,emim dca,acmc-209iqn,basionics™ vs 03,dsstox_cid_27940,dsstox_rid_82692,dsstox_gsid_47964,ksc221g0h
IUPAC Name cyanoiminomethylideneazanide;1-ethyl-3-methylimidazol-3-ium
InChI Key MKHFCTXNDRMIDR-UHFFFAOYSA-N
Molecular Formula C8H11N5
4

2-(1-Naphthyl)-5-phenyloxazole, laser grade and suitable for scintillation spectrometry, 99+%

CAS: 846-63-9 Molecular Formula: C19H13NO Molecular Weight (g/mol): 271.319 MDL Number: MFCD00019714 InChI Key: WWVFJJKBBZXWFV-UHFFFAOYSA-N Synonym: 2-1-naphthyl-5-phenyloxazole,alpha-npo,oxazole, 2-1-naphthalenyl-5-phenyl,2-1-naphthyl-5-phenyl-1,3-oxazole,2-naphthalen-1-yl-5-phenyloxazole,oxazole, 2-1-naphthyl-5-phenyl,.alpha.-npo,anpo,2-alpha-naphthyl-5-phenyloxazole,2-naphthalen-1-yl-5-phenyl-1,3-oxazole PubChem CID: 70058 IUPAC Name: 2-naphthalen-1-yl-5-phenyl-1,3-oxazole SMILES: C1=CC=C(C=C1)C2=CN=C(O2)C3=CC=CC4=CC=CC=C43

PubChem CID 70058
CAS 846-63-9
Molecular Weight (g/mol) 271.319
MDL Number MFCD00019714
SMILES C1=CC=C(C=C1)C2=CN=C(O2)C3=CC=CC4=CC=CC=C43
Synonym 2-1-naphthyl-5-phenyloxazole,alpha-npo,oxazole, 2-1-naphthalenyl-5-phenyl,2-1-naphthyl-5-phenyl-1,3-oxazole,2-naphthalen-1-yl-5-phenyloxazole,oxazole, 2-1-naphthyl-5-phenyl,.alpha.-npo,anpo,2-alpha-naphthyl-5-phenyloxazole,2-naphthalen-1-yl-5-phenyl-1,3-oxazole
IUPAC Name 2-naphthalen-1-yl-5-phenyl-1,3-oxazole
InChI Key WWVFJJKBBZXWFV-UHFFFAOYSA-N
Molecular Formula C19H13NO
5

Thermo Scientific Chemicals Allopurinol, 98%

CAS: 315-30-0 Molecular Formula: C5H4N4O Molecular Weight (g/mol): 136.11 MDL Number: MFCD00599413 InChI Key: OFCNXPDARWKPPY-UHFFFAOYSA-N Synonym: allopurinol,1h-pyrazolo 3,4-d pyrimidin-4-ol,zyloprim,zyloric,lopurin,atisuril,bleminol,caplenal,uripurinol,embarin PubChem CID: 2094 ChEBI: CHEBI:40279 IUPAC Name: 1,2-dihydropyrazolo[3,4-d]pyrimidin-4-one SMILES: O=C1N=CN=C2NNC=C12

PubChem CID 2094
CAS 315-30-0
Molecular Weight (g/mol) 136.11
ChEBI CHEBI:40279
MDL Number MFCD00599413
SMILES O=C1N=CN=C2NNC=C12
Synonym allopurinol,1h-pyrazolo 3,4-d pyrimidin-4-ol,zyloprim,zyloric,lopurin,atisuril,bleminol,caplenal,uripurinol,embarin
IUPAC Name 1,2-dihydropyrazolo[3,4-d]pyrimidin-4-one
InChI Key OFCNXPDARWKPPY-UHFFFAOYSA-N
Molecular Formula C5H4N4O
6

Thermo Scientific Chemicals 1-Methylimidazole, for biochemistry, anhydrous, AcroSeal™

CAS: 616-47-7 Molecular Formula: C4H6N2 Molecular Weight (g/mol): 82.11 MDL Number: MFCD00005292 InChI Key: MCTWTZJPVLRJOU-UHFFFAOYSA-N IUPAC Name: 1-methyl-1H-imidazole SMILES: CN1C=CN=C1

CAS 616-47-7
Molecular Weight (g/mol) 82.11
MDL Number MFCD00005292
SMILES CN1C=CN=C1
IUPAC Name 1-methyl-1H-imidazole
InChI Key MCTWTZJPVLRJOU-UHFFFAOYSA-N
Molecular Formula C4H6N2
7

1,2,4-Triazole, sodium salt, 90%, technical

CAS: 41253-21-8 Molecular Formula: C2H2N3Na Molecular Weight (g/mol): 91.05 MDL Number: MFCD00044437 InChI Key: NVMNEWNGLGACBB-UHFFFAOYSA-N Synonym: sodium 1,2,4-triazol-1-ide,1,2,4-triazolylsodium,1,2,4-triazole sodium derivative,1,2,4-triazole sodium salt,sodium 1,2,4-triazolide,1h-1,2,4-triazole, sodium salt,sodium 1h-1,2,4-triazolate,1,2,4-triazole sodium,sodium 1h-1,2,4-triazolide,1,2,4-triazole, sodium salt PubChem CID: 4649906 IUPAC Name: sodium;2,4-diaza-1-azanidacyclopenta-2,4-diene SMILES: C1=NC=N[N-]1.[Na+]

PubChem CID 4649906
CAS 41253-21-8
Molecular Weight (g/mol) 91.05
MDL Number MFCD00044437
SMILES C1=NC=N[N-]1.[Na+]
Synonym sodium 1,2,4-triazol-1-ide,1,2,4-triazolylsodium,1,2,4-triazole sodium derivative,1,2,4-triazole sodium salt,sodium 1,2,4-triazolide,1h-1,2,4-triazole, sodium salt,sodium 1h-1,2,4-triazolate,1,2,4-triazole sodium,sodium 1h-1,2,4-triazolide,1,2,4-triazole, sodium salt
IUPAC Name sodium;2,4-diaza-1-azanidacyclopenta-2,4-diene
InChI Key NVMNEWNGLGACBB-UHFFFAOYSA-N
Molecular Formula C2H2N3Na
8

1,2-Dimethylimidazole, 96+%

CAS: 1739-84-0 Molecular Formula: C5H8N2 Molecular Weight (g/mol): 96.13 MDL Number: MFCD00005294 InChI Key: GIWQSPITLQVMSG-UHFFFAOYSA-N Synonym: 1,2-dimethyl-1h-imidazole,1h-imidazole, 1,2-dimethyl,imidazole, 1,2-dimethyl,1h-imidazole, dimethyl,unii-q41bc3grjb,q41bc3grjb,lupragen r dmi,1,2-dimethylimdazole,1,2 dimethylimidazole,n,2-dimethylimidazole PubChem CID: 15617 IUPAC Name: 1,2-dimethylimidazole SMILES: CN1C=CN=C1C

PubChem CID 15617
CAS 1739-84-0
Molecular Weight (g/mol) 96.13
MDL Number MFCD00005294
SMILES CN1C=CN=C1C
Synonym 1,2-dimethyl-1h-imidazole,1h-imidazole, 1,2-dimethyl,imidazole, 1,2-dimethyl,1h-imidazole, dimethyl,unii-q41bc3grjb,q41bc3grjb,lupragen r dmi,1,2-dimethylimdazole,1,2 dimethylimidazole,n,2-dimethylimidazole
IUPAC Name 1,2-dimethylimidazole
InChI Key GIWQSPITLQVMSG-UHFFFAOYSA-N
Molecular Formula C5H8N2
9

4-Nitroimidazole, 98%

CAS: 3034-38-6 Molecular Formula: C3H3N3O2 Molecular Weight (g/mol): 113.08 MDL Number: MFCD00005196 InChI Key: VYDWQPKRHOGLPA-UHFFFAOYSA-N Synonym: 4-nitroimidazole,4-nitro-1h-imidazole,1h-imidazole, 4-nitro,5-nitroimidazole,4 5-nitroimidazole,imidazole, 4-nitro,1h-imidazole, 5-nitro,unii-y8u32az5o7,5 4-nitroimidazole,4-nitro-3h-imidazole PubChem CID: 18208 ChEBI: CHEBI:64635 IUPAC Name: 5-nitro-1H-imidazole SMILES: [O-][N+](=O)C1=CN=CN1

PubChem CID 18208
CAS 3034-38-6
Molecular Weight (g/mol) 113.08
ChEBI CHEBI:64635
MDL Number MFCD00005196
SMILES [O-][N+](=O)C1=CN=CN1
Synonym 4-nitroimidazole,4-nitro-1h-imidazole,1h-imidazole, 4-nitro,5-nitroimidazole,4 5-nitroimidazole,imidazole, 4-nitro,1h-imidazole, 5-nitro,unii-y8u32az5o7,5 4-nitroimidazole,4-nitro-3h-imidazole
IUPAC Name 5-nitro-1H-imidazole
InChI Key VYDWQPKRHOGLPA-UHFFFAOYSA-N
Molecular Formula C3H3N3O2
10

GSK840, MedChemExpress

MedChemExpress GSK840 (GSK'840) is a receptor-interacting protein kinase 3 (RIP3 or RIPK3) inhibitor, which binds RIP3 kinase domain with an IC50 of 0.9 nM, and inhibits kinase activity with an IC50 of 0.3 nM.

ENCOMPASS_PREFERRED
Molecular Weight (g/mol) 365.43
Color Light Yellow
Physical Form Solid
Chemical Name or Material GSK840
Grade Research
SMILES O=C(OC(C)(C)C)CC1=CC=C(N2C3=CC=C(C(NC)=O)C=C3N=C2)C=C1
For Use With (Application) COVID-19-immunoregulation
Percent Purity 98.0%
CAS 2361146-30-5
Solubility Information DMSO : 110 mg/mL (301.02 mM; Need ultrasonic)
Synonym GSK'840
Purity Grade Notes Research
Recommended Storage Powder -20°C 3 years∣In solvent -80°C 6 months, -20°C 1 month
Shelf Life Powder -20°C 3 years∣In solvent -80°C 6 months, -20°C 1 month
Molecular Formula C21H23N3O3
Formula Weight 365.43
11

Delamanid, MedChemExpress

MedChemExpress Delamanid, a newer mycobacterial cell wall synthesis inhibitor, inhibits the synthesisi of mucolic acids.

ENCOMPASS_PREFERRED
Molecular Weight (g/mol) 534.48
Color Off-White
Physical Form Solid
Chemical Name or Material Delamanid
Grade Research
SMILES FC(F)(F)OC1=CC=C(OC2CCN(C3=CC=C(OC[C@@]4(C)CN5C(O4)=NC([N+]([O-])=O)=C5)C=C3)CC2)C=C1
For Use With (Application) Cancer-programmed cell death
Percent Purity 98.72%
CAS 681492-22-8
Solubility Information DMSO : ≥ 50 mg/mL (93.55 mM) ∣Ethanol : 2 mg/mL (3.74 mM; Need ultrasonic)
Synonym OPC-67683
Purity Grade Notes Research
Recommended Storage Powder -20°C 3 years, 4°C 2 years∣In solvent -80°C 6 months, -20°C 1 month
Shelf Life Powder -20°C 3 years, 4°C 2 years∣In solvent -80°C 6 months, -20°C 1 month
Molecular Formula C25H25F3N4O6
Formula Weight 534.48
12

TC13172, MedChemExpress

MedChemExpress TC13172 is a mixed lineage kinase domain-like protein (MLKL) inhibitor with an EC50 value of 2 nM for HT-29 cells.

ENCOMPASS_PREFERRED
Molecular Weight (g/mol) 388.4
Color Light Yellow
Physical Form Solid
Chemical Name or Material TC13172
Grade Research
SMILES O=C1C2=C(N=C(S(C)(=O)=O)N2C)N(CC#CC3=CC(O)=CC=C3)C(N1C)=O
For Use With (Application) Cancer-Kinase/protease
Percent Purity 98.73%
CAS 2093393-05-4
Solubility Information DMSO : 25 mg/mL (64.37 mM; Need ultrasonic)
Purity Grade Notes Research
Recommended Storage Powder -20°C 3 years, 4°C 2 years∣In solvent -80°C 6 months, -20°C 1 month
Shelf Life Powder -20°C 3 years, 4°C 2 years∣In solvent -80°C 6 months, -20°C 1 month
Molecular Formula C17H16N4O5S
Formula Weight 388.4
13

(Z)-9-Propenyladenine, MedChemExpress

MedChemExpress (Z)-9-Propenyladenine is a mutagenic impurity in tenofovir disoproxil fumarate. Tenofovir is an antiretroviral drug known as nucleotide analogue reverse transcriptase (NtART) inhibitor, which blocks reverse transcriptase, a crucial virus enzyme in HIV-1 and HBV.

ENCOMPASS_PREFERRED
Molecular Weight (g/mol) 175.19
Color White
Physical Form Solid
Chemical Name or Material (Z)-9-Propenyladenine
Grade Research
SMILES NC1=C2N=CN(/C=C\C)C2=NC=N1
For Use With (Application) COVID-19-anti-virus
Percent Purity 98.02%
CAS 1464851-21-5
Solubility Information DMSO : ≥ 100 mg/mL (570.81 mM)
Synonym (Z)-Mutagenic Impurity of Tenofovir Disoproxil
Purity Grade Notes Research
Recommended Storage Powder -20°C 3 years, 4°C 2 years∣In solvent -80°C 6 months, -20°C 1 month
Shelf Life Powder -20°C 3 years, 4°C 2 years∣In solvent -80°C 6 months, -20°C 1 month
Molecular Formula C8H9N5
Formula Weight 175.19
14

Azeliragon, MedChemExpress

MedChemExpress Azeliragon (TTP488) is an orally bioavailable inhibitor of the receptor for advanced glycation end products (RAGE) in development as a potential treatment to slow disease progression in patients with mild Alzheimer’s disease (AD). Azeliragon also can cross the blood-brain barrier (BBB).

ENCOMPASS_PREFERRED
Molecular Weight (g/mol) 532.12
Color White
Physical Form Solid
Chemical Name or Material Azeliragon
Grade Research
SMILES ClC1=CC=C(C=C1)OC2=CC=C(C=C2)N3C(CCCC)=NC(C(C=C4)=CC=C4OCCCN(CC)CC)=C3
For Use With (Application) Neuroscience-Neurodegeneration
Percent Purity 98.79%
CAS 603148-36-3
Solubility Information DMSO : 50 mg/mL (93.96 mM; Need ultrasonic)
Synonym TTP488 PF-04494700
Purity Grade Notes Research
Recommended Storage Powder -20°C 3 years, 4°C 2 years∣In solvent -80°C 6 months, -20°C 1 month
Shelf Life Powder -20°C 3 years, 4°C 2 years∣In solvent -80°C 6 months, -20°C 1 month
Molecular Formula C32H38ClN3O2
Formula Weight 532.12
15

MIR96-IN-1, MedChemExpress

MedChemExpress MIR96-IN-1 targets the Drosha site in the miR-96 (miRNA-96, microRNA-96) hairpin precursor, inhibiting its biogenesis, derepressing downstream targets, and triggering apoptosis in breast cancer cells. MIR96-IN-1 binds to RNAs with Kds of 1.3, 9.4, 3.4, 1.3 and 7.4 μM for RNA1, RNA2, RNA3, RNA4 and RNA5, respectively.

ENCOMPASS_PREFERRED
Molecular Weight (g/mol) 588.79
Color Yellow
Physical Form Solid
Chemical Name or Material MIR96-IN-1
Grade Research
SMILES O=C(NCCCN=[N+]=[N-])CCCOC1=C(C(C)(C)C)C=C(C2=NC3=CC=C(N4CCN(C)CC4)C=C3N2)C=C1C(C)(C)C
For Use With (Application) Cancer-programmed cell death
Percent Purity 95.82%
CAS 1311982-88-3
Solubility Information DMSO : ≥ 100 mg/mL (169.84 mM)
Purity Grade Notes Research
Recommended Storage Powder -20°C 3 years, 4°C 2 years∣In solvent -80°C 6 months, -20°C 1 month
Shelf Life Powder -20°C 3 years, 4°C 2 years∣In solvent -80°C 6 months, -20°C 1 month
Molecular Formula C33H48N8O2
Formula Weight 588.79