4-butoxy-N-{4-[5-(3,4-dimethoxyphenyl)-1H-1,2,3-triazol-1-yl]phenyl}benzamide
Chemical Structure Depiction of
4-butoxy-N-{4-[5-(3,4-dimethoxyphenyl)-1H-1,2,3-triazol-1-yl]phenyl}benzamide
4-butoxy-N-{4-[5-(3,4-dimethoxyphenyl)-1H-1,2,3-triazol-1-yl]phenyl}benzamide
Compound characteristics
| Compound ID: | K415-0206 |
| Compound Name: | 4-butoxy-N-{4-[5-(3,4-dimethoxyphenyl)-1H-1,2,3-triazol-1-yl]phenyl}benzamide |
| Molecular Weight: | 472.54 |
| Molecular Formula: | C27 H28 N4 O4 |
| Smiles: | CCCCOc1ccc(cc1)C(Nc1ccc(cc1)n1c(cnn1)c1ccc(c(c1)OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3225 |
| logD: | 5.3225 |
| logSw: | -5.1963 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.993 |
| InChI Key: | YHTNTBVUPSBGBL-UHFFFAOYSA-N |