N-[2-(cyclohex-1-en-1-yl)ethyl]-1-[(4-methylphenyl)methyl]-1H-benzotriazole-5-carboxamide
Chemical Structure Depiction of
N-[2-(cyclohex-1-en-1-yl)ethyl]-1-[(4-methylphenyl)methyl]-1H-benzotriazole-5-carboxamide
N-[2-(cyclohex-1-en-1-yl)ethyl]-1-[(4-methylphenyl)methyl]-1H-benzotriazole-5-carboxamide
Compound characteristics
| Compound ID: | L455-0661 |
| Compound Name: | N-[2-(cyclohex-1-en-1-yl)ethyl]-1-[(4-methylphenyl)methyl]-1H-benzotriazole-5-carboxamide |
| Molecular Weight: | 374.48 |
| Molecular Formula: | C23 H26 N4 O |
| Smiles: | Cc1ccc(Cn2c3ccc(cc3nn2)C(NCCC2CCCCC=2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.7902 |
| logD: | 3.7902 |
| logSw: | -3.8652 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.111 |
| InChI Key: | MLMASFLCXOTDNQ-UHFFFAOYSA-N |