rel-(3aR,6aR)-2-benzyl-5-(2,4-dimethoxybenzoyl)-N,N-dimethylhexahydropyrrolo[3,4-c]pyrrole-3a(1H)-carboxamide
Chemical Structure Depiction of
rel-(3aR,6aR)-2-benzyl-5-(2,4-dimethoxybenzoyl)-N,N-dimethylhexahydropyrrolo[3,4-c]pyrrole-3a(1H)-carboxamide
rel-(3aR,6aR)-2-benzyl-5-(2,4-dimethoxybenzoyl)-N,N-dimethylhexahydropyrrolo[3,4-c]pyrrole-3a(1H)-carboxamide
Compound characteristics
| Compound ID: | S984-0129 |
| Compound Name: | rel-(3aR,6aR)-2-benzyl-5-(2,4-dimethoxybenzoyl)-N,N-dimethylhexahydropyrrolo[3,4-c]pyrrole-3a(1H)-carboxamide |
| Molecular Weight: | 437.54 |
| Molecular Formula: | C25 H31 N3 O4 |
| Smiles: | CN(C)C([C@@]12CN(Cc3ccccc3)C[C@H]2CN(C1)C(c1ccc(cc1OC)OC)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.7806 |
| logD: | -2.6187 |
| logSw: | -2.6803 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.988 |
| InChI Key: | LNHBRNCEZFKHLP-CLOONOSVSA-N |