rel-(3aR,6aR)-2-(ethoxyacetyl)-N,N-dimethyl-5-[(pyridin-3-yl)methyl]hexahydropyrrolo[3,4-c]pyrrole-3a(1H)-carboxamide
Chemical Structure Depiction of
rel-(3aR,6aR)-2-(ethoxyacetyl)-N,N-dimethyl-5-[(pyridin-3-yl)methyl]hexahydropyrrolo[3,4-c]pyrrole-3a(1H)-carboxamide
rel-(3aR,6aR)-2-(ethoxyacetyl)-N,N-dimethyl-5-[(pyridin-3-yl)methyl]hexahydropyrrolo[3,4-c]pyrrole-3a(1H)-carboxamide
Compound characteristics
| Compound ID: | S984-0336 |
| Compound Name: | rel-(3aR,6aR)-2-(ethoxyacetyl)-N,N-dimethyl-5-[(pyridin-3-yl)methyl]hexahydropyrrolo[3,4-c]pyrrole-3a(1H)-carboxamide |
| Molecular Weight: | 360.46 |
| Molecular Formula: | C19 H28 N4 O3 |
| Smiles: | CCOCC(N1C[C@@H]2CN(Cc3cccnc3)C[C@@]2(C1)C(N(C)C)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | -1.0289 |
| logD: | -4.902 |
| logSw: | -0.4773 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 54.135 |
| InChI Key: | TUDKYFBCOZNOGL-LPHOPBHVSA-N |