N-(3-chloro-2-methylphenyl)-2-{[4-cyclohexyl-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(3-chloro-2-methylphenyl)-2-{[4-cyclohexyl-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
N-(3-chloro-2-methylphenyl)-2-{[4-cyclohexyl-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | 8014-2019 |
| Compound Name: | N-(3-chloro-2-methylphenyl)-2-{[4-cyclohexyl-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide |
| Molecular Weight: | 441.98 |
| Molecular Formula: | C22 H24 Cl N5 O S |
| Smiles: | Cc1c(cccc1[Cl])NC(CSc1nnc(c2cccnc2)n1C1CCCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4124 |
| logD: | 4.4041 |
| logSw: | -4.3755 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.515 |
| InChI Key: | LHSDACWXALDYHA-UHFFFAOYSA-N |