N-(3-chloro-2-methylphenyl)-2-[3,5-dimethyl-4-(3-methylbutyl)-1H-pyrazol-1-yl]-4-methyl-1,3-thiazole-5-carboxamide
Chemical Structure Depiction of
N-(3-chloro-2-methylphenyl)-2-[3,5-dimethyl-4-(3-methylbutyl)-1H-pyrazol-1-yl]-4-methyl-1,3-thiazole-5-carboxamide
N-(3-chloro-2-methylphenyl)-2-[3,5-dimethyl-4-(3-methylbutyl)-1H-pyrazol-1-yl]-4-methyl-1,3-thiazole-5-carboxamide
Compound characteristics
| Compound ID: | D314-0580 |
| Compound Name: | N-(3-chloro-2-methylphenyl)-2-[3,5-dimethyl-4-(3-methylbutyl)-1H-pyrazol-1-yl]-4-methyl-1,3-thiazole-5-carboxamide |
| Molecular Weight: | 431 |
| Molecular Formula: | C22 H27 Cl N4 O S |
| Smiles: | CC(C)CCc1c(C)nn(c1C)c1nc(C)c(C(Nc2cccc(c2C)[Cl])=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 6.0951 |
| logD: | 6.0702 |
| logSw: | -6.0132 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.447 |
| InChI Key: | YMCHDMBXOLFOHA-UHFFFAOYSA-N |