3-bromo-N-[2-(3-chlorophenyl)-2H-benzotriazol-5-yl]-4-ethoxybenzamide
Chemical Structure Depiction of
3-bromo-N-[2-(3-chlorophenyl)-2H-benzotriazol-5-yl]-4-ethoxybenzamide
3-bromo-N-[2-(3-chlorophenyl)-2H-benzotriazol-5-yl]-4-ethoxybenzamide
Compound characteristics
| Compound ID: | 2081-0812 |
| Compound Name: | 3-bromo-N-[2-(3-chlorophenyl)-2H-benzotriazol-5-yl]-4-ethoxybenzamide |
| Molecular Weight: | 471.74 |
| Molecular Formula: | C21 H16 Br Cl N4 O2 |
| Smiles: | CCOc1ccc(cc1[Br])C(Nc1ccc2c(c1)nn(c1cccc(c1)[Cl])n2)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9086 |
| logD: | 5.8533 |
| logSw: | -6.0612 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.574 |
| InChI Key: | VSNNGMMKKQZQKA-UHFFFAOYSA-N |