rel-(3aR,6aR)-2-[3-(3,5-dimethyl-1H-pyrazol-1-yl)propanoyl]-N,N-dimethyl-5-[(pyridin-3-yl)methyl]hexahydropyrrolo[3,4-c]pyrrole-3a(1H)-carboxamide
Chemical Structure Depiction of
rel-(3aR,6aR)-2-[3-(3,5-dimethyl-1H-pyrazol-1-yl)propanoyl]-N,N-dimethyl-5-[(pyridin-3-yl)methyl]hexahydropyrrolo[3,4-c]pyrrole-3a(1H)-carboxamide
rel-(3aR,6aR)-2-[3-(3,5-dimethyl-1H-pyrazol-1-yl)propanoyl]-N,N-dimethyl-5-[(pyridin-3-yl)methyl]hexahydropyrrolo[3,4-c]pyrrole-3a(1H)-carboxamide
Compound characteristics
| Compound ID: | S984-0379 |
| Compound Name: | rel-(3aR,6aR)-2-[3-(3,5-dimethyl-1H-pyrazol-1-yl)propanoyl]-N,N-dimethyl-5-[(pyridin-3-yl)methyl]hexahydropyrrolo[3,4-c]pyrrole-3a(1H)-carboxamide |
| Molecular Weight: | 424.55 |
| Molecular Formula: | C23 H32 N6 O2 |
| Smiles: | Cc1cc(C)n(CCC(N2C[C@@H]3CN(Cc4cccnc4)C[C@@]3(C2)C(N(C)C)=O)=O)n1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | -0.9883 |
| logD: | -4.8613 |
| logSw: | -0.6555 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 59.79 |
| InChI Key: | YRIPPEAOXXWBSF-REWPJTCUSA-N |