2-{[5-(4-bromophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(2-hydroxy-3-methoxyphenyl)methylidene]acetohydrazide
Chemical Structure Depiction of
2-{[5-(4-bromophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(2-hydroxy-3-methoxyphenyl)methylidene]acetohydrazide
2-{[5-(4-bromophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(2-hydroxy-3-methoxyphenyl)methylidene]acetohydrazide
Compound characteristics
| Compound ID: | 3254-2211 |
| Compound Name: | 2-{[5-(4-bromophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(2-hydroxy-3-methoxyphenyl)methylidene]acetohydrazide |
| Molecular Weight: | 538.42 |
| Molecular Formula: | C24 H20 Br N5 O3 S |
| Smiles: | COc1cccc(/C=N/NC(CSc2nnc(c3ccc(cc3)[Br])n2c2ccccc2)=O)c1O |
| Stereo: | ACHIRAL |
| logP: | 5.3463 |
| logD: | 5.3436 |
| logSw: | -5.295 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 83.196 |
| InChI Key: | MMSFMLPJEQYIDG-UHFFFAOYSA-N |