N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-[(4-methylphenyl)methyl]-1H-benzotriazole-5-carboxamide
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-[(4-methylphenyl)methyl]-1H-benzotriazole-5-carboxamide
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-[(4-methylphenyl)methyl]-1H-benzotriazole-5-carboxamide
Compound characteristics
| Compound ID: | L455-0654 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-[(4-methylphenyl)methyl]-1H-benzotriazole-5-carboxamide |
| Molecular Weight: | 400.44 |
| Molecular Formula: | C23 H20 N4 O3 |
| Smiles: | Cc1ccc(Cn2c3ccc(cc3nn2)C(Nc2ccc3c(c2)OCCO3)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.7929 |
| logD: | 2.7913 |
| logSw: | -3.2511 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.579 |
| InChI Key: | GFCJAMVQXLKFHT-UHFFFAOYSA-N |