2-{[5-(3,4-dimethoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(4-propoxyphenyl)methylidene]acetohydrazide
Chemical Structure Depiction of
2-{[5-(3,4-dimethoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(4-propoxyphenyl)methylidene]acetohydrazide
2-{[5-(3,4-dimethoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(4-propoxyphenyl)methylidene]acetohydrazide
Compound characteristics
| Compound ID: | 3254-0558 |
| Compound Name: | 2-{[5-(3,4-dimethoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(4-propoxyphenyl)methylidene]acetohydrazide |
| Molecular Weight: | 531.63 |
| Molecular Formula: | C28 H29 N5 O4 S |
| Smiles: | CCCOc1ccc(/C=N/NC(CSc2nnc(c3ccc(c(c3)OC)OC)n2c2ccccc2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.0718 |
| logD: | 5.0716 |
| logSw: | -4.7271 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.765 |
| InChI Key: | GDPQAPBGQWDLPV-UHFFFAOYSA-N |