3-(3,4-dimethoxyphenyl)-N-{4-[5-(4-methoxyphenyl)-1H-1,2,3-triazol-1-yl]phenyl}prop-2-enamide
Chemical Structure Depiction of
3-(3,4-dimethoxyphenyl)-N-{4-[5-(4-methoxyphenyl)-1H-1,2,3-triazol-1-yl]phenyl}prop-2-enamide
3-(3,4-dimethoxyphenyl)-N-{4-[5-(4-methoxyphenyl)-1H-1,2,3-triazol-1-yl]phenyl}prop-2-enamide
Compound characteristics
| Compound ID: | K415-0151 |
| Compound Name: | 3-(3,4-dimethoxyphenyl)-N-{4-[5-(4-methoxyphenyl)-1H-1,2,3-triazol-1-yl]phenyl}prop-2-enamide |
| Molecular Weight: | 456.5 |
| Molecular Formula: | C26 H24 N4 O4 |
| Smiles: | COc1ccc(cc1)c1cnnn1c1ccc(cc1)NC(/C=C/c1ccc(c(c1)OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7552 |
| logD: | 4.7551 |
| logSw: | -4.48 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.905 |
| InChI Key: | PNRFSLCNWNBSIH-UHFFFAOYSA-N |