N-{[4-(dimethylamino)phenyl]methyl}-1-methyl-1H-benzotriazole-5-carboxamide
Chemical Structure Depiction of
N-{[4-(dimethylamino)phenyl]methyl}-1-methyl-1H-benzotriazole-5-carboxamide
N-{[4-(dimethylamino)phenyl]methyl}-1-methyl-1H-benzotriazole-5-carboxamide
Compound characteristics
| Compound ID: | F058-0286 |
| Compound Name: | N-{[4-(dimethylamino)phenyl]methyl}-1-methyl-1H-benzotriazole-5-carboxamide |
| Molecular Weight: | 309.37 |
| Molecular Formula: | C17 H19 N5 O |
| Smiles: | CN(C)c1ccc(CNC(c2ccc3c(c2)nnn3C)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 1.7299 |
| logD: | 1.7145 |
| logSw: | -2.3219 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.44 |
| InChI Key: | ISALBNBJIXEZAQ-UHFFFAOYSA-N |