1-[rel-(3aR,6aR)-5-methyl-3a-(pyrrolidine-1-carbonyl)hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl]-3-(3-phenyl-1,2-oxazol-4-yl)propan-1-one
Chemical Structure Depiction of
1-[rel-(3aR,6aR)-5-methyl-3a-(pyrrolidine-1-carbonyl)hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl]-3-(3-phenyl-1,2-oxazol-4-yl)propan-1-one
1-[rel-(3aR,6aR)-5-methyl-3a-(pyrrolidine-1-carbonyl)hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl]-3-(3-phenyl-1,2-oxazol-4-yl)propan-1-one
Compound characteristics
| Compound ID: | S985-0056 |
| Compound Name: | 1-[rel-(3aR,6aR)-5-methyl-3a-(pyrrolidine-1-carbonyl)hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl]-3-(3-phenyl-1,2-oxazol-4-yl)propan-1-one |
| Molecular Weight: | 422.53 |
| Molecular Formula: | C24 H30 N4 O3 |
| Smiles: | CN1C[C@H]2CN(C[C@]2(C1)C(N1CCCC1)=O)C(CCc1conc1c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.927 |
| logD: | -3.7467 |
| logSw: | -2.1859 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 61.236 |
| InChI Key: | OIABECJKLQIBSQ-RDPSFJRHSA-N |