rel-(3aR,6aR)-N,N-dimethyl-2-[(pyridin-3-yl)methyl]-5-(thiophene-2-carbonyl)hexahydropyrrolo[3,4-c]pyrrole-3a(1H)-carboxamide
Chemical Structure Depiction of
rel-(3aR,6aR)-N,N-dimethyl-2-[(pyridin-3-yl)methyl]-5-(thiophene-2-carbonyl)hexahydropyrrolo[3,4-c]pyrrole-3a(1H)-carboxamide
rel-(3aR,6aR)-N,N-dimethyl-2-[(pyridin-3-yl)methyl]-5-(thiophene-2-carbonyl)hexahydropyrrolo[3,4-c]pyrrole-3a(1H)-carboxamide
Compound characteristics
| Compound ID: | S984-0319 |
| Compound Name: | rel-(3aR,6aR)-N,N-dimethyl-2-[(pyridin-3-yl)methyl]-5-(thiophene-2-carbonyl)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(Cc3cccnc3)C[C@H]2CN(C1)C(c1cccs1)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.5215 |
| logD: | -3.2353 |
| logSw: | -1.1943 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.35 |
| InChI Key: | NCSZAMIBMCSHLE-UZLBHIALSA-N |