N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-benzyl-1H-benzotriazole-5-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-benzyl-1H-benzotriazole-5-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-benzyl-1H-benzotriazole-5-carboxamide
Compound characteristics
| Compound ID: | L455-0885 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-benzyl-1H-benzotriazole-5-carboxamide |
| Molecular Weight: | 386.41 |
| Molecular Formula: | C22 H18 N4 O3 |
| Smiles: | C(c1ccc2c(c1)OCO2)NC(c1ccc2c(c1)nnn2Cc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.976 |
| logD: | 2.976 |
| logSw: | -3.3373 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.193 |
| InChI Key: | HWWCHRQRDWHOMS-UHFFFAOYSA-N |