2-[(4-amino-5-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(3-chloro-4-fluorophenyl)acetamide
Chemical Structure Depiction of
2-[(4-amino-5-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(3-chloro-4-fluorophenyl)acetamide
2-[(4-amino-5-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(3-chloro-4-fluorophenyl)acetamide
Compound characteristics
| Compound ID: | 8016-2196 |
| Compound Name: | 2-[(4-amino-5-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(3-chloro-4-fluorophenyl)acetamide |
| Molecular Weight: | 315.75 |
| Molecular Formula: | C11 H11 Cl F N5 O S |
| Smiles: | Cc1nnc(n1N)SCC(Nc1ccc(c(c1)[Cl])F)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2482 |
| logD: | 1.24 |
| logSw: | -2.797 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 66.337 |
| InChI Key: | FFQQXOLQLWOHCQ-UHFFFAOYSA-N |