rel-(3aR,6aR)-N,N-dimethyl-2-(1-methyl-1H-pyrazole-3-carbonyl)-5-(propan-2-yl)hexahydropyrrolo[3,4-c]pyrrole-3a(1H)-carboxamide
Chemical Structure Depiction of
rel-(3aR,6aR)-N,N-dimethyl-2-(1-methyl-1H-pyrazole-3-carbonyl)-5-(propan-2-yl)hexahydropyrrolo[3,4-c]pyrrole-3a(1H)-carboxamide
rel-(3aR,6aR)-N,N-dimethyl-2-(1-methyl-1H-pyrazole-3-carbonyl)-5-(propan-2-yl)hexahydropyrrolo[3,4-c]pyrrole-3a(1H)-carboxamide
Compound characteristics
| Compound ID: | S984-0095 |
| Compound Name: | rel-(3aR,6aR)-N,N-dimethyl-2-(1-methyl-1H-pyrazole-3-carbonyl)-5-(propan-2-yl)hexahydropyrrolo[3,4-c]pyrrole-3a(1H)-carboxamide |
| Molecular Weight: | 333.43 |
| Molecular Formula: | C17 H27 N5 O2 |
| Smiles: | CC(C)N1C[C@H]2CN(C[C@]2(C1)C(N(C)C)=O)C(c1ccn(C)n1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | -0.5418 |
| logD: | -6.4448 |
| logSw: | -1.1529 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 51.83 |
| InChI Key: | CNPHCUBVPQGLTR-DYVFJYSZSA-N |