N-[(4-butoxyphenyl)methyl]-7,8,9,10-tetrahydro-6H-azepino[1,2-a]benzimidazole-3-carboxamide
Chemical Structure Depiction of
N-[(4-butoxyphenyl)methyl]-7,8,9,10-tetrahydro-6H-azepino[1,2-a]benzimidazole-3-carboxamide
N-[(4-butoxyphenyl)methyl]-7,8,9,10-tetrahydro-6H-azepino[1,2-a]benzimidazole-3-carboxamide
Compound characteristics
| Compound ID: | G730-0989 |
| Compound Name: | N-[(4-butoxyphenyl)methyl]-7,8,9,10-tetrahydro-6H-azepino[1,2-a]benzimidazole-3-carboxamide |
| Molecular Weight: | 391.51 |
| Molecular Formula: | C24 H29 N3 O2 |
| Smiles: | CCCCOc1ccc(CNC(c2ccc3c(c2)nc2CCCCCn23)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.8837 |
| logD: | 4.8815 |
| logSw: | -4.5307 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.602 |
| InChI Key: | ZLLWLQFWZWXTRC-UHFFFAOYSA-N |