2-[2-(4-butyl-3,5-dimethyl-1H-pyrazol-1-yl)-1,3-thiazol-4-yl]-N-(3-chloro-4-methylphenyl)acetamide
Chemical Structure Depiction of
2-[2-(4-butyl-3,5-dimethyl-1H-pyrazol-1-yl)-1,3-thiazol-4-yl]-N-(3-chloro-4-methylphenyl)acetamide
2-[2-(4-butyl-3,5-dimethyl-1H-pyrazol-1-yl)-1,3-thiazol-4-yl]-N-(3-chloro-4-methylphenyl)acetamide
Compound characteristics
Compound ID: | D351-0748 |
Compound Name: | 2-[2-(4-butyl-3,5-dimethyl-1H-pyrazol-1-yl)-1,3-thiazol-4-yl]-N-(3-chloro-4-methylphenyl)acetamide |
Molecular Weight: | 416.97 |
Molecular Formula: | C21 H25 Cl N4 O S |
Smiles: | CCCCc1c(C)nn(c1C)c1nc(CC(Nc2ccc(C)c(c2)[Cl])=O)cs1 |
Stereo: | ACHIRAL |
logP: | 6.331 |
logD: | 6.3307 |
logSw: | -6.1205 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 47.85 |
InChI Key: | VKHHZRHAVYNMBY-UHFFFAOYSA-N |