N-(3-chloro-2-methylphenyl)-2-[(3-hydroxy-6-methyl-1,2,4-triazin-5-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(3-chloro-2-methylphenyl)-2-[(3-hydroxy-6-methyl-1,2,4-triazin-5-yl)sulfanyl]acetamide
N-(3-chloro-2-methylphenyl)-2-[(3-hydroxy-6-methyl-1,2,4-triazin-5-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | D084-0508 |
| Compound Name: | N-(3-chloro-2-methylphenyl)-2-[(3-hydroxy-6-methyl-1,2,4-triazin-5-yl)sulfanyl]acetamide |
| Molecular Weight: | 324.79 |
| Molecular Formula: | C13 H13 Cl N4 O2 S |
| Smiles: | Cc1c(cccc1[Cl])NC(CSc1c(C)nnc(n1)O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8854 |
| logD: | 1.8782 |
| logSw: | -2.5979 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.726 |
| InChI Key: | DAGDOQCMYOLYHL-UHFFFAOYSA-N |