4-[7-[(5-cyclohexyl-1H-pyrazol-4-yl)methyl]-1-methyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-3-yl]-2-methyl-1,3-thiazole

C21H28N6S — CID 26137203

IUPAC4-[7-[(5-cyclohexyl-1H-pyrazol-4-yl)methyl]-1-methyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-3-yl]-2-methyl-1,3-thiazole
SMILESCc1nc(-c2nc(C)c3n2CCN(Cc2cn[nH]c2C2CCCCC2)C3)cs1
InChIInChI=1S/C21H28N6S/c1-14-19-12-26(8-9-27(19)21(23-14)18-13-28-15(2)24-18)11-17-10-22-25-20(17)16-6-4-3-5-7-16/h10,13,16H,3-9,11-12H2,1-2H3,(H,22,25)
InChIKeyZCYOBVONNCBTIM-UHFFFAOYSA-N
MW396.56 g/mol
LogP4.41
Rot. Bonds4

About 4-[7-[(5-cyclohexyl-1H-pyrazol-4-yl)methyl]-1-methyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-3-yl]-2-methyl-1,3-thiazole

4-[7-[(5-cyclohexyl-1H-pyrazol-4-yl)methyl]-1-methyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-3-yl]-2-methyl-1,3-thiazole (PubChem CID 26137203) has the molecular formula C21H28N6S and a molecular weight of 396.56 g/mol. Its IUPAC name is 4-[7-[(5-cyclohexyl-1H-pyrazol-4-yl)methyl]-1-methyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-3-yl]-2-methyl-1,3-thiazole.

Molecular Properties

Compound Name4-[7-[(5-cyclohexyl-1H-pyrazol-4-yl)methyl]-1-methyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-3-yl]-2-methyl-1,3-thiazole
PubChem CID26137203
Molecular FormulaC21H28N6S
Molecular Weight396.56 g/mol
Exact Mass396.21
IUPAC Name4-[7-[(5-cyclohexyl-1H-pyrazol-4-yl)methyl]-1-methyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-3-yl]-2-methyl-1,3-thiazole
SMILESCc1nc(-c2nc(C)c3n2CCN(Cc2cn[nH]c2C2CCCCC2)C3)cs1
InChIInChI=1S/C21H28N6S/c1-14-19-12-26(8-9-27(19)21(23-14)18-13-28-15(2)24-18)11-17-10-22-25-20(17)16-6-4-3-5-7-16/h10,13,16H,3-9,11-12H2,1-2H3,(H,22,25)
InChIKeyZCYOBVONNCBTIM-UHFFFAOYSA-N
XLogP4.41
TPSA62.63 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.56
LogP ≤ 54.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 4-[7-[(5-cyclohexyl-1H-pyrazol-4-yl)methyl]-1-methyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-3-yl]-2-methyl-1,3-thiazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-[[4-(1H-pyrazol-5-yl)piperidin-1-yl]methyl]-2-pyrimidin-2-yl-1,3-thiazole
CID 51104521
4-[(1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)methyl]-2-(1-methylpyrazol-4-yl)-1,3-thiazole
CID 53581656
4-[(1S)-1-[2-(5-tert-butyl-1H-pyrazol-3-yl)imidazol-1-yl]ethyl]-2-methyl-1,3-thiazole
CID 95555738
2-[6-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-8-methylimidazo[1,2-a]pyridin-3-yl]-1,3-thiazole
CID 22031519
4-[5-fluoro-4-(4-methylimidazol-1-yl)cyclohexa-2,4-dien-1-yl]-N-(2-methyl-4,5,6,7-tetrahydroindazol-3-yl)-1,3-thiazol-2-amine
CID 139378502
2-ethyl-4-[[5-(5-methyl-1H-pyrazol-3-yl)-4-phenylimidazol-1-yl]methyl]-1,3-thiazole
CID 50981011
2-{1-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-1H-imidazol-2-yl}-4-methyl-1,3-thiazole
CID 56867971
3-(3,5-dimethyl-1H-pyrazol-4-yl)-1-[1-methyl-3-(2-methyl-1,3-thiazol-4-yl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]propan-1-one
CID 26142446
4-cyclohexyl-2-(2-methyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-3-yl)-5-(1H-1,2,4-triazol-5-yl)-1,3-thiazole
CID 46865401
2-[4-[(4R)-9-(1-cyclopropylethyl)-4-ethyl-1-methyl-4,5-dihydro-[1,2,4]triazolo[4,3-f]pteridin-7-yl]-1H-pyrazol-5-yl]-1,3-thiazole
CID 67498464
2-[4-[(4R)-9-(1-cyclopropylethyl)-4-ethyl-4,5-dihydro-[1,2,4]triazolo[4,3-f]pteridin-7-yl]-1H-pyrazol-5-yl]-1,3-thiazole
CID 67499077
2-[Imidazol-1-yl-(2-methyl-8-propyl-[1,2,4]triazolo[1,5-c]pyrimidin-7-yl)methyl]-1,3-thiazole
CID 91309132

Frequently Asked Questions

What is the IUPAC name of 4-[7-[(5-cyclohexyl-1H-pyrazol-4-yl)methyl]-1-methyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-3-yl]-2-methyl-1,3-thiazole?
The IUPAC name of 4-[7-[(5-cyclohexyl-1H-pyrazol-4-yl)methyl]-1-methyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-3-yl]-2-methyl-1,3-thiazole (CID 26137203) is 4-[7-[(5-cyclohexyl-1H-pyrazol-4-yl)methyl]-1-methyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-3-yl]-2-methyl-1,3-thiazole.
What is the SMILES notation for 4-[7-[(5-cyclohexyl-1H-pyrazol-4-yl)methyl]-1-methyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-3-yl]-2-methyl-1,3-thiazole?
The canonical SMILES for 4-[7-[(5-cyclohexyl-1H-pyrazol-4-yl)methyl]-1-methyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-3-yl]-2-methyl-1,3-thiazole is Cc1nc(-c2nc(C)c3n2CCN(Cc2cn[nH]c2C2CCCCC2)C3)cs1.
What is the InChIKey of 4-[7-[(5-cyclohexyl-1H-pyrazol-4-yl)methyl]-1-methyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-3-yl]-2-methyl-1,3-thiazole?
The InChIKey is ZCYOBVONNCBTIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H28N6S/c1-14-19-12-26(8-9-27(19)21(23-14)18-13-28-15(2)24-18)11-17-10-22-25-20(17)16-6-4-3-5-7-16/h10,13,16H,3-9,11-12H2,1-2H3,(H,22,25).
What are the key properties of 4-[7-[(5-cyclohexyl-1H-pyrazol-4-yl)methyl]-1-methyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-3-yl]-2-methyl-1,3-thiazole?
4-[7-[(5-cyclohexyl-1H-pyrazol-4-yl)methyl]-1-methyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-3-yl]-2-methyl-1,3-thiazole has a molecular weight of 396.56 g/mol, XLogP of 4.41, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[7-[(5-cyclohexyl-1H-pyrazol-4-yl)methyl]-1-methyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-3-yl]-2-methyl-1,3-thiazole is sourced from PubChem (CID 26137203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).