rel-(3aR,6aR)-N,N-dimethyl-2-(pyridine-4-carbonyl)-5-[(thiophen-2-yl)methyl]hexahydropyrrolo[3,4-c]pyrrole-3a(1H)-carboxamide
Chemical Structure Depiction of
rel-(3aR,6aR)-N,N-dimethyl-2-(pyridine-4-carbonyl)-5-[(thiophen-2-yl)methyl]hexahydropyrrolo[3,4-c]pyrrole-3a(1H)-carboxamide
rel-(3aR,6aR)-N,N-dimethyl-2-(pyridine-4-carbonyl)-5-[(thiophen-2-yl)methyl]hexahydropyrrolo[3,4-c]pyrrole-3a(1H)-carboxamide
Compound characteristics
| Compound ID: | S984-0510 |
| Compound Name: | rel-(3aR,6aR)-N,N-dimethyl-2-(pyridine-4-carbonyl)-5-[(thiophen-2-yl)methyl]hexahydropyrrolo[3,4-c]pyrrole-3a(1H)-carboxamide |
| Molecular Weight: | 384.5 |
| Molecular Formula: | C20 H24 N4 O2 S |
| Smiles: | CN(C)C([C@]12CN(Cc3cccs3)C[C@@H]2CN(C1)C(c1ccncc1)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.278 |
| logD: | -3.9298 |
| logSw: | -1.3675 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.261 |
| InChI Key: | WAEDPQWCXHITKK-UZLBHIALSA-N |