N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-(2-phenyl-5,6,7,8-tetrahydrocyclohepta[b]pyrrol-1(4H)-yl)benzamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-(2-phenyl-5,6,7,8-tetrahydrocyclohepta[b]pyrrol-1(4H)-yl)benzamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-(2-phenyl-5,6,7,8-tetrahydrocyclohepta[b]pyrrol-1(4H)-yl)benzamide
Compound characteristics
| Compound ID: | E221-1297 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-(2-phenyl-5,6,7,8-tetrahydrocyclohepta[b]pyrrol-1(4H)-yl)benzamide |
| Molecular Weight: | 464.56 |
| Molecular Formula: | C30 H28 N2 O3 |
| Smiles: | C1CCc2cc(c3ccccc3)n(c3ccc(cc3)C(NCc3ccc4c(c3)OCO4)=O)c2CC1 |
| Stereo: | ACHIRAL |
| logP: | 6.3834 |
| logD: | 6.3834 |
| logSw: | -6.0767 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.426 |
| InChI Key: | WDNKIYDHCGTIRJ-UHFFFAOYSA-N |