rel-(3aR,6aR)-N,N-dimethyl-2-(pyrazine-2-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-(pyrazine-2-carbonyl)-5-[(thiophen-3-yl)acetyl]hexahydropyrrolo[3,4-c]pyrrole-3a(1H)-carboxamide
rel-(3aR,6aR)-N,N-dimethyl-2-(pyrazine-2-carbonyl)-5-[(thiophen-3-yl)acetyl]hexahydropyrrolo[3,4-c]pyrrole-3a(1H)-carboxamide
Compound characteristics
| Compound ID: | S984-0847 |
| Compound Name: | rel-(3aR,6aR)-N,N-dimethyl-2-(pyrazine-2-carbonyl)-5-[(thiophen-3-yl)acetyl]hexahydropyrrolo[3,4-c]pyrrole-3a(1H)-carboxamide |
| Molecular Weight: | 413.5 |
| Molecular Formula: | C20 H23 N5 O3 S |
| Smiles: | CN(C)C([C@]12CN(C[C@@H]2CN(C1)C(c1cnccn1)=O)C(Cc1ccsc1)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | -0.3519 |
| logD: | -0.3519 |
| logSw: | -1.2446 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 68.786 |
| InChI Key: | HKNVIBCHUHDFJO-QRWLVFNGSA-N |