N-(2-ethyl-6-methylphenyl)-2-[(3-hydroxy-1,2,4-triazin-5-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(2-ethyl-6-methylphenyl)-2-[(3-hydroxy-1,2,4-triazin-5-yl)sulfanyl]acetamide
N-(2-ethyl-6-methylphenyl)-2-[(3-hydroxy-1,2,4-triazin-5-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | D084-0745 |
| Compound Name: | N-(2-ethyl-6-methylphenyl)-2-[(3-hydroxy-1,2,4-triazin-5-yl)sulfanyl]acetamide |
| Molecular Weight: | 304.37 |
| Molecular Formula: | C14 H16 N4 O2 S |
| Smiles: | CCc1cccc(C)c1NC(CSc1cnnc(n1)O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.487 |
| logD: | 1.4679 |
| logSw: | -2.191 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.61 |
| InChI Key: | BBSQZMYEIVYUJA-UHFFFAOYSA-N |