2-{[5-(2,4-dichlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-methoxy-4-nitrophenyl)acetamide
Chemical Structure Depiction of
2-{[5-(2,4-dichlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-methoxy-4-nitrophenyl)acetamide
2-{[5-(2,4-dichlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-methoxy-4-nitrophenyl)acetamide
Compound characteristics
| Compound ID: | 8017-4307 |
| Compound Name: | 2-{[5-(2,4-dichlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-methoxy-4-nitrophenyl)acetamide |
| Molecular Weight: | 482.34 |
| Molecular Formula: | C19 H17 Cl2 N5 O4 S |
| Smiles: | CCn1c(c2ccc(cc2[Cl])[Cl])nnc1SCC(Nc1ccc(cc1OC)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5969 |
| logD: | 4.5573 |
| logSw: | -4.8991 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.429 |
| InChI Key: | YAVKNROZLIZQIY-UHFFFAOYSA-N |