2-(4-butyl-3,5-dimethyl-1H-pyrazol-1-yl)-N-(3-chloro-4-methylphenyl)-4-methyl-1,3-thiazole-5-carboxamide
Chemical Structure Depiction of
2-(4-butyl-3,5-dimethyl-1H-pyrazol-1-yl)-N-(3-chloro-4-methylphenyl)-4-methyl-1,3-thiazole-5-carboxamide
2-(4-butyl-3,5-dimethyl-1H-pyrazol-1-yl)-N-(3-chloro-4-methylphenyl)-4-methyl-1,3-thiazole-5-carboxamide
Compound characteristics
Compound ID: | D314-0188 |
Compound Name: | 2-(4-butyl-3,5-dimethyl-1H-pyrazol-1-yl)-N-(3-chloro-4-methylphenyl)-4-methyl-1,3-thiazole-5-carboxamide |
Molecular Weight: | 416.97 |
Molecular Formula: | C21 H25 Cl N4 O S |
Smiles: | CCCCc1c(C)nn(c1C)c1nc(C)c(C(Nc2ccc(C)c(c2)[Cl])=O)s1 |
Stereo: | ACHIRAL |
logP: | 6.365 |
logD: | 6.3459 |
logSw: | -6.1586 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 48.145 |
InChI Key: | UQSKPDZTVLXVLM-UHFFFAOYSA-N |