N-(2-chloro-4-fluorophenyl)-1-methyl-1H-benzotriazole-5-carboxamide
Chemical Structure Depiction of
N-(2-chloro-4-fluorophenyl)-1-methyl-1H-benzotriazole-5-carboxamide
N-(2-chloro-4-fluorophenyl)-1-methyl-1H-benzotriazole-5-carboxamide
Compound characteristics
Compound ID: | F058-0182 |
Compound Name: | N-(2-chloro-4-fluorophenyl)-1-methyl-1H-benzotriazole-5-carboxamide |
Molecular Weight: | 304.71 |
Molecular Formula: | C14 H10 Cl F N4 O |
Smiles: | Cn1c2ccc(cc2nn1)C(Nc1ccc(cc1[Cl])F)=O |
Stereo: | ACHIRAL |
logP: | 2.6054 |
logD: | 2.3271 |
logSw: | -3.5825 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 48.615 |
InChI Key: | GQWQRVIKCONOAO-UHFFFAOYSA-N |