1-benzyl-N-[(3,4-dimethoxyphenyl)methyl]-1H-benzotriazole-5-carboxamide
Chemical Structure Depiction of
1-benzyl-N-[(3,4-dimethoxyphenyl)methyl]-1H-benzotriazole-5-carboxamide
1-benzyl-N-[(3,4-dimethoxyphenyl)methyl]-1H-benzotriazole-5-carboxamide
Compound characteristics
| Compound ID: | G373-3219 |
| Compound Name: | 1-benzyl-N-[(3,4-dimethoxyphenyl)methyl]-1H-benzotriazole-5-carboxamide |
| Molecular Weight: | 402.45 |
| Molecular Formula: | C23 H22 N4 O3 |
| Smiles: | COc1ccc(CNC(c2ccc3c(c2)nnn3Cc2ccccc2)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 2.6778 |
| logD: | 2.6778 |
| logSw: | -3.1345 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.339 |
| InChI Key: | FLWUNUPUXSXXPM-UHFFFAOYSA-N |