[rel-(3aR,6aR)-2-(propan-2-yl)-5-(quinoline-8-sulfonyl)hexahydropyrrolo[3,4-c]pyrrol-3a(1H)-yl](pyrrolidin-1-yl)methanone
Chemical Structure Depiction of
[rel-(3aR,6aR)-2-(propan-2-yl)-5-(quinoline-8-sulfonyl)hexahydropyrrolo[3,4-c]pyrrol-3a(1H)-yl](pyrrolidin-1-yl)methanone
[rel-(3aR,6aR)-2-(propan-2-yl)-5-(quinoline-8-sulfonyl)hexahydropyrrolo[3,4-c]pyrrol-3a(1H)-yl](pyrrolidin-1-yl)methanone
Compound characteristics
| Compound ID: | S985-0155 |
| Compound Name: | [rel-(3aR,6aR)-2-(propan-2-yl)-5-(quinoline-8-sulfonyl)hexahydropyrrolo[3,4-c]pyrrol-3a(1H)-yl](pyrrolidin-1-yl)methanone |
| Molecular Weight: | 442.58 |
| Molecular Formula: | C23 H30 N4 O3 S |
| Smiles: | CC(C)N1C[C@H]2CN(C[C@]2(C1)C(N1CCCC1)=O)S(c1cccc2cccnc12)(=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.0314 |
| logD: | -2.4313 |
| logSw: | -2.2775 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 62.747 |
| InChI Key: | KIXOLUUXCWWGQY-XXBNENTESA-N |