rel-(3R,3aR,5R,6aR,7S)-N-[3-(dibenzylcarbamoyl)phenyl]-2-oxohexahydro-2H-3,5-methanocyclopenta[b]furan-7-carboxamide
Chemical Structure Depiction of
rel-(3R,3aR,5R,6aR,7S)-N-[3-(dibenzylcarbamoyl)phenyl]-2-oxohexahydro-2H-3,5-methanocyclopenta[b]furan-7-carboxamide
rel-(3R,3aR,5R,6aR,7S)-N-[3-(dibenzylcarbamoyl)phenyl]-2-oxohexahydro-2H-3,5-methanocyclopenta[b]furan-7-carboxamide
Compound characteristics
| Compound ID: | D167-0136 |
| Compound Name: | rel-(3R,3aR,5R,6aR,7S)-N-[3-(dibenzylcarbamoyl)phenyl]-2-oxohexahydro-2H-3,5-methanocyclopenta[b]furan-7-carboxamide |
| Molecular Weight: | 480.56 |
| Molecular Formula: | C30 H28 N2 O4 |
| Smiles: | C1[C@H]2[C@@H]3C(=O)O[C@H]2C[C@H]1[C@H]3C(Nc1cccc(c1)C(N(Cc1ccccc1)Cc1ccccc1)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.996 |
| logD: | 3.996 |
| logSw: | -4.3473 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.709 |
| InChI Key: | AEYIGQXSKXFPDP-KFRGZICISA-N |