N'-[(3,4-dimethoxyphenyl)methylidene]-2-{[4-phenyl-5-(3,4,5-trimethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide
Chemical Structure Depiction of
N'-[(3,4-dimethoxyphenyl)methylidene]-2-{[4-phenyl-5-(3,4,5-trimethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide
N'-[(3,4-dimethoxyphenyl)methylidene]-2-{[4-phenyl-5-(3,4,5-trimethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide
Compound characteristics
| Compound ID: | 3254-2479 |
| Compound Name: | N'-[(3,4-dimethoxyphenyl)methylidene]-2-{[4-phenyl-5-(3,4,5-trimethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide |
| Molecular Weight: | 563.63 |
| Molecular Formula: | C28 H29 N5 O6 S |
| Smiles: | COc1ccc(/C=N/NC(CSc2nnc(c3cc(c(c(c3)OC)OC)OC)n2c2ccccc2)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 3.738 |
| logD: | 3.7379 |
| logSw: | -4.0111 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 98.325 |
| InChI Key: | ZQVGXEYCLWYNQV-UHFFFAOYSA-N |