N-(5-chloro-2-methoxyphenyl)-2-[(3-hydroxy-1,2,4-triazin-5-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(5-chloro-2-methoxyphenyl)-2-[(3-hydroxy-1,2,4-triazin-5-yl)sulfanyl]acetamide
N-(5-chloro-2-methoxyphenyl)-2-[(3-hydroxy-1,2,4-triazin-5-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | D084-0761 |
| Compound Name: | N-(5-chloro-2-methoxyphenyl)-2-[(3-hydroxy-1,2,4-triazin-5-yl)sulfanyl]acetamide |
| Molecular Weight: | 326.76 |
| Molecular Formula: | C12 H11 Cl N4 O3 S |
| Smiles: | COc1ccc(cc1NC(CSc1cnnc(n1)O)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 1.0712 |
| logD: | 1.0521 |
| logSw: | -2.633 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.939 |
| InChI Key: | KBQDIUXESIDREJ-UHFFFAOYSA-N |