N-(3-chloro-4-fluorophenyl)-2-[(3-hydroxy-6-methyl-1,2,4-triazin-5-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-2-[(3-hydroxy-6-methyl-1,2,4-triazin-5-yl)sulfanyl]acetamide
N-(3-chloro-4-fluorophenyl)-2-[(3-hydroxy-6-methyl-1,2,4-triazin-5-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | D084-0558 |
| Compound Name: | N-(3-chloro-4-fluorophenyl)-2-[(3-hydroxy-6-methyl-1,2,4-triazin-5-yl)sulfanyl]acetamide |
| Molecular Weight: | 328.75 |
| Molecular Formula: | C12 H10 Cl F N4 O2 S |
| Smiles: | Cc1c(nc(nn1)O)SCC(Nc1ccc(c(c1)[Cl])F)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8082 |
| logD: | 1.7984 |
| logSw: | -2.7835 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.424 |
| InChI Key: | VKDGOBLRBYWVFV-UHFFFAOYSA-N |