2-(5-bromo-3-nitro-1H-1,2,4-triazol-1-yl)-N-(4-chlorophenyl)acetamide
Chemical Structure Depiction of
2-(5-bromo-3-nitro-1H-1,2,4-triazol-1-yl)-N-(4-chlorophenyl)acetamide
2-(5-bromo-3-nitro-1H-1,2,4-triazol-1-yl)-N-(4-chlorophenyl)acetamide
Compound characteristics
| Compound ID: | 8017-1616 |
| Compound Name: | 2-(5-bromo-3-nitro-1H-1,2,4-triazol-1-yl)-N-(4-chlorophenyl)acetamide |
| Molecular Weight: | 360.55 |
| Molecular Formula: | C10 H7 Br Cl N5 O3 |
| Smiles: | C(C(Nc1ccc(cc1)[Cl])=O)n1c(nc(n1)[N+]([O-])=O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 2.3302 |
| logD: | 2.3301 |
| logSw: | -3.2452 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.082 |
| InChI Key: | USMCVWUGLKNDLS-UHFFFAOYSA-N |