rel-(3aR,6aR)-N,N-dimethyl-2-(1-methyl-1H-pyrrole-2-carbonyl)-5-(pyridine-4-carbonyl)hexahydropyrrolo[3,4-c]pyrrole-3a(1H)-carboxamide
Chemical Structure Depiction of
rel-(3aR,6aR)-N,N-dimethyl-2-(1-methyl-1H-pyrrole-2-carbonyl)-5-(pyridine-4-carbonyl)hexahydropyrrolo[3,4-c]pyrrole-3a(1H)-carboxamide
rel-(3aR,6aR)-N,N-dimethyl-2-(1-methyl-1H-pyrrole-2-carbonyl)-5-(pyridine-4-carbonyl)hexahydropyrrolo[3,4-c]pyrrole-3a(1H)-carboxamide
Compound characteristics
| Compound ID: | S984-0485 |
| Compound Name: | rel-(3aR,6aR)-N,N-dimethyl-2-(1-methyl-1H-pyrrole-2-carbonyl)-5-(pyridine-4-carbonyl)hexahydropyrrolo[3,4-c]pyrrole-3a(1H)-carboxamide |
| Molecular Weight: | 395.46 |
| Molecular Formula: | C21 H25 N5 O3 |
| Smiles: | CN(C)C([C@@]12CN(C[C@H]2CN(C1)C(c1cccn1C)=O)C(c1ccncc1)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | -0.0459 |
| logD: | -0.0483 |
| logSw: | -0.575 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 61.575 |
| InChI Key: | WLZVQSGRMLBXBG-HRAATJIYSA-N |