rel-(3aR,6aS)-5-(3,4-dimethylbenzene-1-sulfonyl)-2-[1-(thiophen-2-yl)propyl]tetrahydropyrrolo[3,4-c]pyrrole-1,3(2H,3aH)-dione
Chemical Structure Depiction of
rel-(3aR,6aS)-5-(3,4-dimethylbenzene-1-sulfonyl)-2-[1-(thiophen-2-yl)propyl]tetrahydropyrrolo[3,4-c]pyrrole-1,3(2H,3aH)-dione
rel-(3aR,6aS)-5-(3,4-dimethylbenzene-1-sulfonyl)-2-[1-(thiophen-2-yl)propyl]tetrahydropyrrolo[3,4-c]pyrrole-1,3(2H,3aH)-dione
Compound characteristics
| Compound ID: | S296-4847 |
| Compound Name: | rel-(3aR,6aS)-5-(3,4-dimethylbenzene-1-sulfonyl)-2-[1-(thiophen-2-yl)propyl]tetrahydropyrrolo[3,4-c]pyrrole-1,3(2H,3aH)-dione |
| Molecular Weight: | 432.56 |
| Molecular Formula: | C21 H24 N2 O4 S2 |
| Smiles: | CCC(c1cccs1)N1C([C@@H]2CN(C[C@@H]2C1=O)S(c1ccc(C)c(C)c1)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2987 |
| logD: | 3.2987 |
| logSw: | -3.5508 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 61.379 |
| InChI Key: | HYGKSAIPDXRRPV-JWTNVVGKSA-N |