2-{[5-(4-bromophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(2,4-dimethoxyphenyl)methylidene]acetohydrazide
Chemical Structure Depiction of
2-{[5-(4-bromophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(2,4-dimethoxyphenyl)methylidene]acetohydrazide
2-{[5-(4-bromophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(2,4-dimethoxyphenyl)methylidene]acetohydrazide
Compound characteristics
| Compound ID: | 3254-2181 |
| Compound Name: | 2-{[5-(4-bromophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(2,4-dimethoxyphenyl)methylidene]acetohydrazide |
| Molecular Weight: | 552.45 |
| Molecular Formula: | C25 H22 Br N5 O3 S |
| Smiles: | COc1ccc(/C=N/NC(CSc2nnc(c3ccc(cc3)[Br])n2c2ccccc2)=O)c(c1)OC |
| Stereo: | ACHIRAL |
| logP: | 5.6849 |
| logD: | 5.6848 |
| logSw: | -5.4755 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.261 |
| InChI Key: | YFBJCNCSYRTWET-UHFFFAOYSA-N |