N'-[(2-chloro-5-nitrophenyl)methylidene]-2-{[5-(4-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide
Chemical Structure Depiction of
N'-[(2-chloro-5-nitrophenyl)methylidene]-2-{[5-(4-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide
N'-[(2-chloro-5-nitrophenyl)methylidene]-2-{[5-(4-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide
Compound characteristics
| Compound ID: | 3254-0616 |
| Compound Name: | N'-[(2-chloro-5-nitrophenyl)methylidene]-2-{[5-(4-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide |
| Molecular Weight: | 527.39 |
| Molecular Formula: | C23 H16 Cl2 N6 O3 S |
| Smiles: | C(C(N/N=C/c1cc(ccc1[Cl])[N+]([O-])=O)=O)Sc1nnc(c2ccc(cc2)[Cl])n1c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.9965 |
| logD: | 5.9944 |
| logSw: | -6.209 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 93.468 |
| InChI Key: | RGPVIWFPDVQUJQ-UHFFFAOYSA-N |