rel-(3aR,6aR)-2-benzoyl-5-(cyclohexylmethyl)-N,N-dimethylhexahydropyrrolo[3,4-c]pyrrole-3a(1H)-carboxamide
Chemical Structure Depiction of
rel-(3aR,6aR)-2-benzoyl-5-(cyclohexylmethyl)-N,N-dimethylhexahydropyrrolo[3,4-c]pyrrole-3a(1H)-carboxamide
rel-(3aR,6aR)-2-benzoyl-5-(cyclohexylmethyl)-N,N-dimethylhexahydropyrrolo[3,4-c]pyrrole-3a(1H)-carboxamide
Compound characteristics
| Compound ID: | S984-0962 |
| Compound Name: | rel-(3aR,6aR)-2-benzoyl-5-(cyclohexylmethyl)-N,N-dimethylhexahydropyrrolo[3,4-c]pyrrole-3a(1H)-carboxamide |
| Molecular Weight: | 383.53 |
| Molecular Formula: | C23 H33 N3 O2 |
| Smiles: | CN(C)C([C@]12CN(CC3CCCCC3)C[C@@H]2CN(C1)C(c1ccccc1)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.3359 |
| logD: | -2.6573 |
| logSw: | -2.4769 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 37.006 |
| InChI Key: | MWTDOOMLSZXRNG-OFNKIYASSA-N |