2-{[5-(4-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-(2-chloro-3-phenylprop-2-en-1-ylidene)acetohydrazide
Chemical Structure Depiction of
2-{[5-(4-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-(2-chloro-3-phenylprop-2-en-1-ylidene)acetohydrazide
2-{[5-(4-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-(2-chloro-3-phenylprop-2-en-1-ylidene)acetohydrazide
Compound characteristics
| Compound ID: | 3254-1438 |
| Compound Name: | 2-{[5-(4-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-(2-chloro-3-phenylprop-2-en-1-ylidene)acetohydrazide |
| Molecular Weight: | 522.46 |
| Molecular Formula: | C26 H21 Cl2 N5 O S |
| Smiles: | Cc1ccc(cc1)n1c(c2ccc(cc2)[Cl])nnc1SCC(N/N=C/C(=C/c1ccccc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 6.9004 |
| logD: | 6.8983 |
| logSw: | -6.3782 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.086 |
| InChI Key: | QNCWVCRLSDYMKQ-UHFFFAOYSA-N |