N-{4-[5-(4-bromophenyl)-1H-1,2,3-triazol-1-yl]phenyl}-4-methoxybenzamide
Chemical Structure Depiction of
N-{4-[5-(4-bromophenyl)-1H-1,2,3-triazol-1-yl]phenyl}-4-methoxybenzamide
N-{4-[5-(4-bromophenyl)-1H-1,2,3-triazol-1-yl]phenyl}-4-methoxybenzamide
Compound characteristics
| Compound ID: | K415-0122 |
| Compound Name: | N-{4-[5-(4-bromophenyl)-1H-1,2,3-triazol-1-yl]phenyl}-4-methoxybenzamide |
| Molecular Weight: | 449.31 |
| Molecular Formula: | C22 H17 Br N4 O2 |
| Smiles: | COc1ccc(cc1)C(Nc1ccc(cc1)n1c(cnn1)c1ccc(cc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 5.2059 |
| logD: | 5.2058 |
| logSw: | -5.0427 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.858 |
| InChI Key: | UAJPHUDIXBLTJC-UHFFFAOYSA-N |