2-{[4-(4-chlorophenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(3,4-dimethoxyphenyl)methylidene]acetohydrazide
Chemical Structure Depiction of
2-{[4-(4-chlorophenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(3,4-dimethoxyphenyl)methylidene]acetohydrazide
2-{[4-(4-chlorophenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(3,4-dimethoxyphenyl)methylidene]acetohydrazide
Compound characteristics
| Compound ID: | 3254-2884 |
| Compound Name: | 2-{[4-(4-chlorophenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(3,4-dimethoxyphenyl)methylidene]acetohydrazide |
| Molecular Weight: | 508 |
| Molecular Formula: | C25 H22 Cl N5 O3 S |
| Smiles: | COc1ccc(/C=N/NC(CSc2nnc(c3ccccc3)n2c2ccc(cc2)[Cl])=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 4.8668 |
| logD: | 4.8667 |
| logSw: | -5.1592 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.347 |
| InChI Key: | MLWFFRIQVJQOQZ-UHFFFAOYSA-N |