[rel-(3aR,6aR)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-5-(oxan-4-yl)hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl](5-methylthiophen-2-yl)methanone
Chemical Structure Depiction of
[rel-(3aR,6aR)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-5-(oxan-4-yl)hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl](5-methylthiophen-2-yl)methanone
[rel-(3aR,6aR)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-5-(oxan-4-yl)hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl](5-methylthiophen-2-yl)methanone
Compound characteristics
| Compound ID: | S988-1238 |
| Compound Name: | [rel-(3aR,6aR)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-5-(oxan-4-yl)hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl](5-methylthiophen-2-yl)methanone |
| Molecular Weight: | 402.51 |
| Molecular Formula: | C20 H26 N4 O3 S |
| Smiles: | Cc1nc([C@]23CN(C[C@@H]3CN(C2)C(c2ccc(C)s2)=O)C2CCOCC2)on1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.2703 |
| logD: | -3.4273 |
| logSw: | -2.5127 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 60.583 |
| InChI Key: | WGMAIBBPZXLZPS-QRWLVFNGSA-N |