rel-(3aR,5S,6aR)-2-benzyl-5-[(cyclopentanecarbonyl)amino]-N-methylhexahydrocyclopenta[c]pyrrole-3a(1H)-carboxamide
Chemical Structure Depiction of
rel-(3aR,5S,6aR)-2-benzyl-5-[(cyclopentanecarbonyl)amino]-N-methylhexahydrocyclopenta[c]pyrrole-3a(1H)-carboxamide
rel-(3aR,5S,6aR)-2-benzyl-5-[(cyclopentanecarbonyl)amino]-N-methylhexahydrocyclopenta[c]pyrrole-3a(1H)-carboxamide
Compound characteristics
| Compound ID: | SD64-0437 |
| Compound Name: | rel-(3aR,5S,6aR)-2-benzyl-5-[(cyclopentanecarbonyl)amino]-N-methylhexahydrocyclopenta[c]pyrrole-3a(1H)-carboxamide |
| Molecular Weight: | 369.51 |
| Molecular Formula: | C22 H31 N3 O2 |
| Smiles: | [H][C@]12C[C@@H](C[C@@]2(CN(Cc2ccccc2)C1)C(NC)=O)NC(C1CCCC1)=O |
| Stereo: | RELATIVE |
| logP: | 2.3869 |
| logD: | -0.8996 |
| logSw: | -2.658 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 53.83 |
| InChI Key: | IWLQBZRVVACLHN-JQVVWYNYSA-N |