rel-(3aR,5S,6aR)-2-benzyl-N-methyl-5-[2-(2-oxo-1,3-benzoxazol-3(2H)-yl)acetamido]hexahydrocyclopenta[c]pyrrole-3a(1H)-carboxamide
Chemical Structure Depiction of
rel-(3aR,5S,6aR)-2-benzyl-N-methyl-5-[2-(2-oxo-1,3-benzoxazol-3(2H)-yl)acetamido]hexahydrocyclopenta[c]pyrrole-3a(1H)-carboxamide
rel-(3aR,5S,6aR)-2-benzyl-N-methyl-5-[2-(2-oxo-1,3-benzoxazol-3(2H)-yl)acetamido]hexahydrocyclopenta[c]pyrrole-3a(1H)-carboxamide
Compound characteristics
| Compound ID: | SD64-0489 |
| Compound Name: | rel-(3aR,5S,6aR)-2-benzyl-N-methyl-5-[2-(2-oxo-1,3-benzoxazol-3(2H)-yl)acetamido]hexahydrocyclopenta[c]pyrrole-3a(1H)-carboxamide |
| Molecular Weight: | 448.52 |
| Molecular Formula: | C25 H28 N4 O4 |
| Smiles: | [H][C@]12C[C@@H](C[C@@]2(CN(Cc2ccccc2)C1)C(NC)=O)NC(CN1C(=O)Oc2ccccc12)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.8605 |
| logD: | -1.426 |
| logSw: | -2.3125 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.159 |
| InChI Key: | OIEUSIMOXOQLEB-WYEJZRMESA-N |