N-(4-bromo-3-methylphenyl)-4-(2-phenyl-5,6,7,8-tetrahydrocyclohepta[b]pyrrol-1(4H)-yl)benzamide
Chemical Structure Depiction of
N-(4-bromo-3-methylphenyl)-4-(2-phenyl-5,6,7,8-tetrahydrocyclohepta[b]pyrrol-1(4H)-yl)benzamide
N-(4-bromo-3-methylphenyl)-4-(2-phenyl-5,6,7,8-tetrahydrocyclohepta[b]pyrrol-1(4H)-yl)benzamide
Compound characteristics
| Compound ID: | E221-1326 |
| Compound Name: | N-(4-bromo-3-methylphenyl)-4-(2-phenyl-5,6,7,8-tetrahydrocyclohepta[b]pyrrol-1(4H)-yl)benzamide |
| Molecular Weight: | 499.45 |
| Molecular Formula: | C29 H27 Br N2 O |
| Smiles: | Cc1cc(ccc1[Br])NC(c1ccc(cc1)n1c(cc2CCCCCc12)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 7.979 |
| logD: | 7.9746 |
| logSw: | -5.5597 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 24.9887 |
| InChI Key: | QOCPJGYXFRPRHI-UHFFFAOYSA-N |