3-bromo-N-[2-(4-ethylphenyl)-2H-benzotriazol-5-yl]benzamide
Chemical Structure Depiction of
3-bromo-N-[2-(4-ethylphenyl)-2H-benzotriazol-5-yl]benzamide
3-bromo-N-[2-(4-ethylphenyl)-2H-benzotriazol-5-yl]benzamide
Compound characteristics
| Compound ID: | 4528-0006 |
| Compound Name: | 3-bromo-N-[2-(4-ethylphenyl)-2H-benzotriazol-5-yl]benzamide |
| Molecular Weight: | 421.29 |
| Molecular Formula: | C21 H17 Br N4 O |
| Smiles: | CCc1ccc(cc1)n1nc2ccc(cc2n1)NC(c1cccc(c1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 6.0748 |
| logD: | 5.9698 |
| logSw: | -5.4396 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.364 |
| InChI Key: | WKULMQCAQVICSF-UHFFFAOYSA-N |