[rel-(3aR,6aR)-2-(6-methoxy-1H-indole-2-carbonyl)-5-methylhexahydropyrrolo[3,4-c]pyrrol-3a(1H)-yl](pyrrolidin-1-yl)methanone
Chemical Structure Depiction of
[rel-(3aR,6aR)-2-(6-methoxy-1H-indole-2-carbonyl)-5-methylhexahydropyrrolo[3,4-c]pyrrol-3a(1H)-yl](pyrrolidin-1-yl)methanone
[rel-(3aR,6aR)-2-(6-methoxy-1H-indole-2-carbonyl)-5-methylhexahydropyrrolo[3,4-c]pyrrol-3a(1H)-yl](pyrrolidin-1-yl)methanone
Compound characteristics
| Compound ID: | S985-0069 |
| Compound Name: | [rel-(3aR,6aR)-2-(6-methoxy-1H-indole-2-carbonyl)-5-methylhexahydropyrrolo[3,4-c]pyrrol-3a(1H)-yl](pyrrolidin-1-yl)methanone |
| Molecular Weight: | 396.49 |
| Molecular Formula: | C22 H28 N4 O3 |
| Smiles: | CN1C[C@H]2CN(C[C@]2(C1)C(N1CCCC1)=O)C(c1cc2ccc(cc2[nH]1)OC)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.2963 |
| logD: | -3.2612 |
| logSw: | -3.1036 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.657 |
| InChI Key: | LAZKOKHNFCGYAZ-ZHRRBRCNSA-N |