2-{[5-(3,4-dimethoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[3-(2-methoxyphenyl)prop-2-en-1-ylidene]acetohydrazide
Chemical Structure Depiction of
2-{[5-(3,4-dimethoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[3-(2-methoxyphenyl)prop-2-en-1-ylidene]acetohydrazide
2-{[5-(3,4-dimethoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[3-(2-methoxyphenyl)prop-2-en-1-ylidene]acetohydrazide
Compound characteristics
| Compound ID: | 2357-3633 |
| Compound Name: | 2-{[5-(3,4-dimethoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[3-(2-methoxyphenyl)prop-2-en-1-ylidene]acetohydrazide |
| Molecular Weight: | 529.62 |
| Molecular Formula: | C28 H27 N5 O4 S |
| Smiles: | COc1ccccc1/C=C/C=N/NC(CSc1nnc(c2ccc(c(c2)OC)OC)n1c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4697 |
| logD: | 4.4695 |
| logSw: | -4.3902 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.609 |
| InChI Key: | CRPWFNWTGKBZKM-UHFFFAOYSA-N |