rel-(3aR,6aS)-5-benzyl-2-[1-(cyclohexylacetyl)piperidin-4-yl]tetrahydropyrrolo[3,4-c]pyrrole-1,3(2H,3aH)-dione
Chemical Structure Depiction of
rel-(3aR,6aS)-5-benzyl-2-[1-(cyclohexylacetyl)piperidin-4-yl]tetrahydropyrrolo[3,4-c]pyrrole-1,3(2H,3aH)-dione
rel-(3aR,6aS)-5-benzyl-2-[1-(cyclohexylacetyl)piperidin-4-yl]tetrahydropyrrolo[3,4-c]pyrrole-1,3(2H,3aH)-dione
Compound characteristics
Compound ID: | S805-0040 |
Compound Name: | rel-(3aR,6aS)-5-benzyl-2-[1-(cyclohexylacetyl)piperidin-4-yl]tetrahydropyrrolo[3,4-c]pyrrole-1,3(2H,3aH)-dione |
Molecular Weight: | 437.58 |
Molecular Formula: | C26 H35 N3 O3 |
Smiles: | C1CCC(CC1)CC(N1CCC(CC1)N1C([C@@H]2CN(Cc3ccccc3)C[C@@H]2C1=O)=O)=O |
Stereo: | RACEMIC MIXTURE (RELATIVE) |
logP: | 2.8865 |
logD: | 1.3367 |
logSw: | -3.1889 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 48.799 |
InChI Key: | RJBBNJXBBXQBHY-GOTSBHOMSA-N |