2-(4-butyl-3,5-dimethyl-1H-pyrazol-1-yl)-N-(5-chloro-2-methylphenyl)-4-methyl-1,3-thiazole-5-carboxamide
Chemical Structure Depiction of
2-(4-butyl-3,5-dimethyl-1H-pyrazol-1-yl)-N-(5-chloro-2-methylphenyl)-4-methyl-1,3-thiazole-5-carboxamide
2-(4-butyl-3,5-dimethyl-1H-pyrazol-1-yl)-N-(5-chloro-2-methylphenyl)-4-methyl-1,3-thiazole-5-carboxamide
Compound characteristics
Compound ID: | D314-0171 |
Compound Name: | 2-(4-butyl-3,5-dimethyl-1H-pyrazol-1-yl)-N-(5-chloro-2-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(Nc2cc(ccc2C)[Cl])=O)s1 |
Stereo: | ACHIRAL |
logP: | 5.6302 |
logD: | 5.6053 |
logSw: | -5.7324 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 47.447 |
InChI Key: | RGULIKFQYGABHD-UHFFFAOYSA-N |