N-butyl-2-{4-[(2-chlorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-1-yl}-4-methyl-1,3-thiazole-5-carboxamide
Chemical Structure Depiction of
N-butyl-2-{4-[(2-chlorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-1-yl}-4-methyl-1,3-thiazole-5-carboxamide
N-butyl-2-{4-[(2-chlorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-1-yl}-4-methyl-1,3-thiazole-5-carboxamide
Compound characteristics
| Compound ID: | D314-0328 |
| Compound Name: | N-butyl-2-{4-[(2-chlorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-1-yl}-4-methyl-1,3-thiazole-5-carboxamide |
| Molecular Weight: | 416.97 |
| Molecular Formula: | C21 H25 Cl N4 O S |
| Smiles: | CCCCNC(c1c(C)nc(n2c(C)c(Cc3ccccc3[Cl])c(C)n2)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.271 |
| logD: | 5.2625 |
| logSw: | -5.682 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.308 |
| InChI Key: | WFVOOKVDHAHWLN-UHFFFAOYSA-N |