2-{[5-(3,4-dimethoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(2-hydroxynaphthalen-1-yl)methylidene]acetohydrazide
Chemical Structure Depiction of
2-{[5-(3,4-dimethoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(2-hydroxynaphthalen-1-yl)methylidene]acetohydrazide
2-{[5-(3,4-dimethoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(2-hydroxynaphthalen-1-yl)methylidene]acetohydrazide
Compound characteristics
| Compound ID: | 2357-3617 |
| Compound Name: | 2-{[5-(3,4-dimethoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(2-hydroxynaphthalen-1-yl)methylidene]acetohydrazide |
| Molecular Weight: | 539.61 |
| Molecular Formula: | C29 H25 N5 O4 S |
| Smiles: | COc1ccc(cc1OC)c1nnc(n1c1ccccc1)SCC(N/N=C/c1c(ccc2ccccc12)O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2344 |
| logD: | 5.2325 |
| logSw: | -5.845 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 91.624 |
| InChI Key: | XCUOSWLUHALTMJ-UHFFFAOYSA-N |