N-[(5-bromo-2-methoxyphenyl)methyl]-7,8,9,10-tetrahydro-6H-azepino[1,2-a]benzimidazole-3-carboxamide
Chemical Structure Depiction of
N-[(5-bromo-2-methoxyphenyl)methyl]-7,8,9,10-tetrahydro-6H-azepino[1,2-a]benzimidazole-3-carboxamide
N-[(5-bromo-2-methoxyphenyl)methyl]-7,8,9,10-tetrahydro-6H-azepino[1,2-a]benzimidazole-3-carboxamide
Compound characteristics
| Compound ID: | G730-0960 |
| Compound Name: | N-[(5-bromo-2-methoxyphenyl)methyl]-7,8,9,10-tetrahydro-6H-azepino[1,2-a]benzimidazole-3-carboxamide |
| Molecular Weight: | 428.33 |
| Molecular Formula: | C21 H22 Br N3 O2 |
| Smiles: | COc1ccc(cc1CNC(c1ccc2c(c1)nc1CCCCCn12)=O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 4.3447 |
| logD: | 4.3424 |
| logSw: | -4.2832 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.815 |
| InChI Key: | XFPCHAYCSSSLOD-UHFFFAOYSA-N |