[rel-(3aR,6aR)-2-(2-ethylbenzene-1-sulfonyl)-5-(propan-2-yl)hexahydropyrrolo[3,4-c]pyrrol-3a(1H)-yl](pyrrolidin-1-yl)methanone
Chemical Structure Depiction of
[rel-(3aR,6aR)-2-(2-ethylbenzene-1-sulfonyl)-5-(propan-2-yl)hexahydropyrrolo[3,4-c]pyrrol-3a(1H)-yl](pyrrolidin-1-yl)methanone
[rel-(3aR,6aR)-2-(2-ethylbenzene-1-sulfonyl)-5-(propan-2-yl)hexahydropyrrolo[3,4-c]pyrrol-3a(1H)-yl](pyrrolidin-1-yl)methanone
Compound characteristics
| Compound ID: | S984-1744 |
| Compound Name: | [rel-(3aR,6aR)-2-(2-ethylbenzene-1-sulfonyl)-5-(propan-2-yl)hexahydropyrrolo[3,4-c]pyrrol-3a(1H)-yl](pyrrolidin-1-yl)methanone |
| Molecular Weight: | 419.59 |
| Molecular Formula: | C22 H33 N3 O3 S |
| Smiles: | CCc1ccccc1S(N1C[C@@H]2CN(C[C@@]2(C1)C(N1CCCC1)=O)C(C)C)(=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.9526 |
| logD: | -1.5101 |
| logSw: | -3.1004 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 53.214 |
| InChI Key: | VSZGTZILVMMDFO-KNQAVFIVSA-N |