rel-(3aR,6aR)-N,N-dimethyl-2-(pyridine-4-carbonyl)-5-[(thiophen-3-yl)acetyl]hexahydropyrrolo[3,4-c]pyrrole-3a(1H)-carboxamide
Chemical Structure Depiction of
rel-(3aR,6aR)-N,N-dimethyl-2-(pyridine-4-carbonyl)-5-[(thiophen-3-yl)acetyl]hexahydropyrrolo[3,4-c]pyrrole-3a(1H)-carboxamide
rel-(3aR,6aR)-N,N-dimethyl-2-(pyridine-4-carbonyl)-5-[(thiophen-3-yl)acetyl]hexahydropyrrolo[3,4-c]pyrrole-3a(1H)-carboxamide
Compound characteristics
| Compound ID: | S984-0447 |
| Compound Name: | rel-(3aR,6aR)-N,N-dimethyl-2-(pyridine-4-carbonyl)-5-[(thiophen-3-yl)acetyl]hexahydropyrrolo[3,4-c]pyrrole-3a(1H)-carboxamide |
| Molecular Weight: | 412.51 |
| Molecular Formula: | C21 H24 N4 O3 S |
| Smiles: | CN(C)C([C@]12CN(C[C@@H]2CN(C1)C(c1ccncc1)=O)C(Cc1ccsc1)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | -0.0418 |
| logD: | -0.0442 |
| logSw: | -1.429 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 59.649 |
| InChI Key: | FWNTYSSAJLFONS-UTKZUKDTSA-N |