N-(4-ethylphenyl)-1-[(4-fluorophenyl)methyl]-1H-benzotriazole-5-carboxamide
Chemical Structure Depiction of
N-(4-ethylphenyl)-1-[(4-fluorophenyl)methyl]-1H-benzotriazole-5-carboxamide
N-(4-ethylphenyl)-1-[(4-fluorophenyl)methyl]-1H-benzotriazole-5-carboxamide
Compound characteristics
| Compound ID: | L455-0452 |
| Compound Name: | N-(4-ethylphenyl)-1-[(4-fluorophenyl)methyl]-1H-benzotriazole-5-carboxamide |
| Molecular Weight: | 374.42 |
| Molecular Formula: | C22 H19 F N4 O |
| Smiles: | CCc1ccc(cc1)NC(c1ccc2c(c1)nnn2Cc1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3567 |
| logD: | 4.3566 |
| logSw: | -4.2453 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.756 |
| InChI Key: | BMGHLAOLKADJTQ-UHFFFAOYSA-N |