2-{[5-(4-bromophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[1-(4-nitrophenyl)ethylidene]acetohydrazide
Chemical Structure Depiction of
2-{[5-(4-bromophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[1-(4-nitrophenyl)ethylidene]acetohydrazide
2-{[5-(4-bromophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[1-(4-nitrophenyl)ethylidene]acetohydrazide
Compound characteristics
| Compound ID: | 3254-2223 |
| Compound Name: | 2-{[5-(4-bromophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[1-(4-nitrophenyl)ethylidene]acetohydrazide |
| Molecular Weight: | 551.42 |
| Molecular Formula: | C24 H19 Br N6 O3 S |
| Smiles: | C/C(c1ccc(cc1)[N+]([O-])=O)=N/NC(CSc1nnc(c2ccc(cc2)[Br])n1c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5996 |
| logD: | 5.5993 |
| logSw: | -5.4916 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 92.756 |
| InChI Key: | QBNIPEPRVTUYAG-UHFFFAOYSA-N |