rel-(3aR,6aR)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-5-(oxan-4-yl)-N-(2-phenylethyl)hexahydropyrrolo[3,4-c]pyrrole-2(1H)-carboxamide
Chemical Structure Depiction of
rel-(3aR,6aR)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-5-(oxan-4-yl)-N-(2-phenylethyl)hexahydropyrrolo[3,4-c]pyrrole-2(1H)-carboxamide
rel-(3aR,6aR)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-5-(oxan-4-yl)-N-(2-phenylethyl)hexahydropyrrolo[3,4-c]pyrrole-2(1H)-carboxamide
Compound characteristics
Compound ID: | S988-0181 |
Compound Name: | rel-(3aR,6aR)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-5-(oxan-4-yl)-N-(2-phenylethyl)hexahydropyrrolo[3,4-c]pyrrole-2(1H)-carboxamide |
Molecular Weight: | 425.53 |
Molecular Formula: | C23 H31 N5 O3 |
Smiles: | Cc1nc([C@]23CN(C[C@@H]3CN(C2)C(NCCc2ccccc2)=O)C2CCOCC2)on1 |
Stereo: | RACEMIC MIXTURE (RELATIVE) |
logP: | 1.94 |
logD: | -3.4973 |
logSw: | -2.383 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 69.55 |
InChI Key: | SZGXCDQKFKVZNR-XXBNENTESA-N |