1-[(4-methylphenyl)methyl]-N-(prop-2-en-1-yl)-1H-benzotriazole-5-carboxamide
Chemical Structure Depiction of
1-[(4-methylphenyl)methyl]-N-(prop-2-en-1-yl)-1H-benzotriazole-5-carboxamide
1-[(4-methylphenyl)methyl]-N-(prop-2-en-1-yl)-1H-benzotriazole-5-carboxamide
Compound characteristics
| Compound ID: | L455-0659 |
| Compound Name: | 1-[(4-methylphenyl)methyl]-N-(prop-2-en-1-yl)-1H-benzotriazole-5-carboxamide |
| Molecular Weight: | 306.37 |
| Molecular Formula: | C18 H18 N4 O |
| Smiles: | Cc1ccc(Cn2c3ccc(cc3nn2)C(NCC=C)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.3159 |
| logD: | 2.3159 |
| logSw: | -2.8196 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.191 |
| InChI Key: | FZZSGCDCLBXXSI-UHFFFAOYSA-N |