N'-[(5-bromo-2-hydroxy-3-nitrophenyl)methylidene]-2-({5-[(2-methylanilino)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetohydrazide
Chemical Structure Depiction of
N'-[(5-bromo-2-hydroxy-3-nitrophenyl)methylidene]-2-({5-[(2-methylanilino)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetohydrazide
N'-[(5-bromo-2-hydroxy-3-nitrophenyl)methylidene]-2-({5-[(2-methylanilino)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetohydrazide
Compound characteristics
| Compound ID: | Y508-8519 |
| Compound Name: | N'-[(5-bromo-2-hydroxy-3-nitrophenyl)methylidene]-2-({5-[(2-methylanilino)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetohydrazide |
| Molecular Weight: | 596.46 |
| Molecular Formula: | C25 H22 Br N7 O4 S |
| Smiles: | Cc1ccccc1NCc1nnc(n1c1ccccc1)SCC(N/N=C/c1cc(cc(c1O)[N+]([O-])=O)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 5.1554 |
| logD: | 4.3173 |
| logSw: | -4.8731 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 119.431 |
| InChI Key: | VHTFEXZTGYLNNX-UHFFFAOYSA-N |