N-{4-[5-(3,4-dimethoxyphenyl)-1H-1,2,3-triazol-1-yl]phenyl}-3,4-dimethoxybenzamide
Chemical Structure Depiction of
N-{4-[5-(3,4-dimethoxyphenyl)-1H-1,2,3-triazol-1-yl]phenyl}-3,4-dimethoxybenzamide
N-{4-[5-(3,4-dimethoxyphenyl)-1H-1,2,3-triazol-1-yl]phenyl}-3,4-dimethoxybenzamide
Compound characteristics
| Compound ID: | K415-0210 |
| Compound Name: | N-{4-[5-(3,4-dimethoxyphenyl)-1H-1,2,3-triazol-1-yl]phenyl}-3,4-dimethoxybenzamide |
| Molecular Weight: | 460.49 |
| Molecular Formula: | C25 H24 N4 O5 |
| Smiles: | COc1ccc(cc1OC)C(Nc1ccc(cc1)n1c(cnn1)c1ccc(c(c1)OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5144 |
| logD: | 3.5144 |
| logSw: | -3.7027 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.836 |
| InChI Key: | CCECRGZYSMUAAQ-UHFFFAOYSA-N |