N-(4-bromo-2-fluorophenyl)-1-methyl-1H-benzotriazole-5-carboxamide
Chemical Structure Depiction of
N-(4-bromo-2-fluorophenyl)-1-methyl-1H-benzotriazole-5-carboxamide
N-(4-bromo-2-fluorophenyl)-1-methyl-1H-benzotriazole-5-carboxamide
Compound characteristics
| Compound ID: | F058-0078 |
| Compound Name: | N-(4-bromo-2-fluorophenyl)-1-methyl-1H-benzotriazole-5-carboxamide |
| Molecular Weight: | 349.16 |
| Molecular Formula: | C14 H10 Br F N4 O |
| Smiles: | Cn1c2ccc(cc2nn1)C(Nc1ccc(cc1F)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 2.8527 |
| logD: | 2.5745 |
| logSw: | -3.5224 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.615 |
| InChI Key: | NWNWBNZCTXVEQN-UHFFFAOYSA-N |