2-{[5-(3,4-dimethoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(4-ethoxyphenyl)methylidene]acetohydrazide
Chemical Structure Depiction of
2-{[5-(3,4-dimethoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(4-ethoxyphenyl)methylidene]acetohydrazide
2-{[5-(3,4-dimethoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(4-ethoxyphenyl)methylidene]acetohydrazide
Compound characteristics
| Compound ID: | 2357-3585 |
| Compound Name: | 2-{[5-(3,4-dimethoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(4-ethoxyphenyl)methylidene]acetohydrazide |
| Molecular Weight: | 517.61 |
| Molecular Formula: | C27 H27 N5 O4 S |
| Smiles: | CCOc1ccc(/C=N/NC(CSc2nnc(c3ccc(c(c3)OC)OC)n2c2ccccc2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.4814 |
| logD: | 4.4812 |
| logSw: | -4.2699 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.471 |
| InChI Key: | MZZAGZWUZFRJED-UHFFFAOYSA-N |