[rel-(3aR,6aR)-2-(3-fluoro-4-methylbenzoyl)-5-methylhexahydropyrrolo[3,4-c]pyrrol-3a(1H)-yl](pyrrolidin-1-yl)methanone
Chemical Structure Depiction of
[rel-(3aR,6aR)-2-(3-fluoro-4-methylbenzoyl)-5-methylhexahydropyrrolo[3,4-c]pyrrol-3a(1H)-yl](pyrrolidin-1-yl)methanone
[rel-(3aR,6aR)-2-(3-fluoro-4-methylbenzoyl)-5-methylhexahydropyrrolo[3,4-c]pyrrol-3a(1H)-yl](pyrrolidin-1-yl)methanone
Compound characteristics
| Compound ID: | S985-0045 |
| Compound Name: | [rel-(3aR,6aR)-2-(3-fluoro-4-methylbenzoyl)-5-methylhexahydropyrrolo[3,4-c]pyrrol-3a(1H)-yl](pyrrolidin-1-yl)methanone |
| Molecular Weight: | 359.44 |
| Molecular Formula: | C20 H26 F N3 O2 |
| Smiles: | Cc1ccc(cc1F)C(N1C[C@@H]2CN(C)C[C@@]2(C1)C(N1CCCC1)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.8417 |
| logD: | -3.7158 |
| logSw: | -2.1654 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 37.764 |
| InChI Key: | QFBCNHCVVHIJRB-UZLBHIALSA-N |