N-[(4-methylphenyl)methyl]-7,8,9,10-tetrahydro-6H-azepino[1,2-a]benzimidazole-3-carboxamide
Chemical Structure Depiction of
N-[(4-methylphenyl)methyl]-7,8,9,10-tetrahydro-6H-azepino[1,2-a]benzimidazole-3-carboxamide
N-[(4-methylphenyl)methyl]-7,8,9,10-tetrahydro-6H-azepino[1,2-a]benzimidazole-3-carboxamide
Compound characteristics
| Compound ID: | G730-0784 |
| Compound Name: | N-[(4-methylphenyl)methyl]-7,8,9,10-tetrahydro-6H-azepino[1,2-a]benzimidazole-3-carboxamide |
| Molecular Weight: | 333.43 |
| Molecular Formula: | C21 H23 N3 O |
| Smiles: | Cc1ccc(CNC(c2ccc3c(c2)nc2CCCCCn23)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.8748 |
| logD: | 3.8725 |
| logSw: | -3.8624 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.184 |
| InChI Key: | RHBYUOQBHPXBOU-UHFFFAOYSA-N |