N-(3-chloro-2-methylphenyl)-2-[(5-cyclopropyl-4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(3-chloro-2-methylphenyl)-2-[(5-cyclopropyl-4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
N-(3-chloro-2-methylphenyl)-2-[(5-cyclopropyl-4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | Y203-0098 |
| Compound Name: | N-(3-chloro-2-methylphenyl)-2-[(5-cyclopropyl-4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide |
| Molecular Weight: | 336.84 |
| Molecular Formula: | C15 H17 Cl N4 O S |
| Smiles: | Cc1c(cccc1[Cl])NC(CSc1nnc(C2CC2)n1C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0316 |
| logD: | 3.0304 |
| logSw: | -3.4573 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.026 |
| InChI Key: | JABDRAUOKDXXKL-UHFFFAOYSA-N |