N-{4-[5-(4-bromophenyl)-1H-1,2,3-triazol-1-yl]phenyl}-3,4-diethoxybenzamide
Chemical Structure Depiction of
N-{4-[5-(4-bromophenyl)-1H-1,2,3-triazol-1-yl]phenyl}-3,4-diethoxybenzamide
N-{4-[5-(4-bromophenyl)-1H-1,2,3-triazol-1-yl]phenyl}-3,4-diethoxybenzamide
Compound characteristics
| Compound ID: | K415-0133 |
| Compound Name: | N-{4-[5-(4-bromophenyl)-1H-1,2,3-triazol-1-yl]phenyl}-3,4-diethoxybenzamide |
| Molecular Weight: | 507.39 |
| Molecular Formula: | C25 H23 Br N4 O3 |
| Smiles: | CCOc1ccc(cc1OCC)C(Nc1ccc(cc1)n1c(cnn1)c1ccc(cc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 5.339 |
| logD: | 5.3389 |
| logSw: | -5.2191 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.734 |
| InChI Key: | CFGBJNAEOSFZTM-UHFFFAOYSA-N |