3-bromo-N-[2-(3-chlorophenyl)-2H-benzotriazol-5-yl]-4-methoxybenzamide
Chemical Structure Depiction of
3-bromo-N-[2-(3-chlorophenyl)-2H-benzotriazol-5-yl]-4-methoxybenzamide
3-bromo-N-[2-(3-chlorophenyl)-2H-benzotriazol-5-yl]-4-methoxybenzamide
Compound characteristics
| Compound ID: | Y508-1532 |
| Compound Name: | 3-bromo-N-[2-(3-chlorophenyl)-2H-benzotriazol-5-yl]-4-methoxybenzamide |
| Molecular Weight: | 457.71 |
| Molecular Formula: | C20 H14 Br Cl N4 O2 |
| Smiles: | COc1ccc(cc1[Br])C(Nc1ccc2c(c1)nn(c1cccc(c1)[Cl])n2)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5421 |
| logD: | 5.4868 |
| logSw: | -6.0069 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.994 |
| InChI Key: | UBKMHRRKVFDHNB-UHFFFAOYSA-N |