1-[(4-methylphenyl)methyl]-N-[3-(trifluoromethyl)phenyl]-1H-benzotriazole-5-carboxamide
Chemical Structure Depiction of
1-[(4-methylphenyl)methyl]-N-[3-(trifluoromethyl)phenyl]-1H-benzotriazole-5-carboxamide
1-[(4-methylphenyl)methyl]-N-[3-(trifluoromethyl)phenyl]-1H-benzotriazole-5-carboxamide
Compound characteristics
| Compound ID: | L455-0561 |
| Compound Name: | 1-[(4-methylphenyl)methyl]-N-[3-(trifluoromethyl)phenyl]-1H-benzotriazole-5-carboxamide |
| Molecular Weight: | 410.4 |
| Molecular Formula: | C22 H17 F3 N4 O |
| Smiles: | Cc1ccc(Cn2c3ccc(cc3nn2)C(Nc2cccc(c2)C(F)(F)F)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.8636 |
| logD: | 4.8434 |
| logSw: | -4.596 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.756 |
| InChI Key: | OEUQMFNAXVDEGH-UHFFFAOYSA-N |