N-benzyl-1-[(3-methoxyphenyl)methyl]-1H-benzotriazole-5-carboxamide
Chemical Structure Depiction of
N-benzyl-1-[(3-methoxyphenyl)methyl]-1H-benzotriazole-5-carboxamide
N-benzyl-1-[(3-methoxyphenyl)methyl]-1H-benzotriazole-5-carboxamide
Compound characteristics
| Compound ID: | L455-0296 |
| Compound Name: | N-benzyl-1-[(3-methoxyphenyl)methyl]-1H-benzotriazole-5-carboxamide |
| Molecular Weight: | 372.43 |
| Molecular Formula: | C22 H20 N4 O2 |
| Smiles: | COc1cccc(Cn2c3ccc(cc3nn2)C(NCc2ccccc2)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.1182 |
| logD: | 3.1182 |
| logSw: | -3.4421 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.622 |
| InChI Key: | XSILAFCUVHSPIK-UHFFFAOYSA-N |