rel-(3aR,6aS)-5-(3,5-dimethyl-1,2-oxazole-4-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-(3,5-dimethyl-1,2-oxazole-4-sulfonyl)-2-[1-(thiophen-2-yl)propyl]tetrahydropyrrolo[3,4-c]pyrrole-1,3(2H,3aH)-dione
rel-(3aR,6aS)-5-(3,5-dimethyl-1,2-oxazole-4-sulfonyl)-2-[1-(thiophen-2-yl)propyl]tetrahydropyrrolo[3,4-c]pyrrole-1,3(2H,3aH)-dione
Compound characteristics
| Compound ID: | S296-4900 |
| Compound Name: | rel-(3aR,6aS)-5-(3,5-dimethyl-1,2-oxazole-4-sulfonyl)-2-[1-(thiophen-2-yl)propyl]tetrahydropyrrolo[3,4-c]pyrrole-1,3(2H,3aH)-dione |
| Molecular Weight: | 423.51 |
| Molecular Formula: | C18 H21 N3 O5 S2 |
| Smiles: | CCC(c1cccs1)N1C([C@@H]2CN(C[C@@H]2C1=O)S(c1c(C)noc1C)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.9828 |
| logD: | 0.9828 |
| logSw: | -2.6053 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 83.417 |
| InChI Key: | SDTSTQBWOUXTSS-PBWFPOADSA-N |