N'-[(4-methoxyphenyl)methylidene]-2-{[4-phenyl-5-(3,4,5-trimethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide
Chemical Structure Depiction of
N'-[(4-methoxyphenyl)methylidene]-2-{[4-phenyl-5-(3,4,5-trimethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide
N'-[(4-methoxyphenyl)methylidene]-2-{[4-phenyl-5-(3,4,5-trimethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide
Compound characteristics
| Compound ID: | Y508-2452 |
| Compound Name: | N'-[(4-methoxyphenyl)methylidene]-2-{[4-phenyl-5-(3,4,5-trimethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide |
| Molecular Weight: | 533.61 |
| Molecular Formula: | C27 H27 N5 O5 S |
| Smiles: | COc1ccc(/C=N/NC(CSc2nnc(c3cc(c(c(c3)OC)OC)OC)n2c2ccccc2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.9548 |
| logD: | 3.9546 |
| logSw: | -4.1345 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.608 |
| InChI Key: | UMYYBEUNTJEKEJ-UHFFFAOYSA-N |