N-(4-bromo-2-fluorophenyl)-1-ethyl-1H-benzotriazole-5-carboxamide
Chemical Structure Depiction of
N-(4-bromo-2-fluorophenyl)-1-ethyl-1H-benzotriazole-5-carboxamide
N-(4-bromo-2-fluorophenyl)-1-ethyl-1H-benzotriazole-5-carboxamide
Compound characteristics
| Compound ID: | F058-0471 |
| Compound Name: | N-(4-bromo-2-fluorophenyl)-1-ethyl-1H-benzotriazole-5-carboxamide |
| Molecular Weight: | 363.19 |
| Molecular Formula: | C15 H12 Br F N4 O |
| Smiles: | CCn1c2ccc(cc2nn1)C(Nc1ccc(cc1F)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 3.2146 |
| logD: | 2.9363 |
| logSw: | -3.459 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.054 |
| InChI Key: | YWCDHKPFJCDNMX-UHFFFAOYSA-N |