N-(3-chlorophenyl)-1-[(4-methoxyphenyl)methyl]-1H-benzotriazole-5-carboxamide
Chemical Structure Depiction of
N-(3-chlorophenyl)-1-[(4-methoxyphenyl)methyl]-1H-benzotriazole-5-carboxamide
N-(3-chlorophenyl)-1-[(4-methoxyphenyl)methyl]-1H-benzotriazole-5-carboxamide
Compound characteristics
| Compound ID: | L455-0022 |
| Compound Name: | N-(3-chlorophenyl)-1-[(4-methoxyphenyl)methyl]-1H-benzotriazole-5-carboxamide |
| Molecular Weight: | 392.84 |
| Molecular Formula: | C21 H17 Cl N4 O2 |
| Smiles: | COc1ccc(Cn2c3ccc(cc3nn2)C(Nc2cccc(c2)[Cl])=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.1329 |
| logD: | 4.1268 |
| logSw: | -4.4916 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.299 |
| InChI Key: | IAWXKBNCHPLJBU-UHFFFAOYSA-N |