N-(3-chloro-4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]-1H-benzotriazole-5-carboxamide
Chemical Structure Depiction of
N-(3-chloro-4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]-1H-benzotriazole-5-carboxamide
N-(3-chloro-4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]-1H-benzotriazole-5-carboxamide
Compound characteristics
| Compound ID: | L455-0113 |
| Compound Name: | N-(3-chloro-4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]-1H-benzotriazole-5-carboxamide |
| Molecular Weight: | 422.87 |
| Molecular Formula: | C22 H19 Cl N4 O3 |
| Smiles: | COc1ccc(Cn2c3ccc(cc3nn2)C(Nc2ccc(c(c2)[Cl])OC)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.89 |
| logD: | 3.8772 |
| logSw: | -4.4363 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.93 |
| InChI Key: | YSQJXPTUBRHHMZ-UHFFFAOYSA-N |