[rel-(3aR,6aR)-2-(5-cyclopropyl-1H-pyrazole-3-carbonyl)-5-(propan-2-yl)hexahydropyrrolo[3,4-c]pyrrol-3a(1H)-yl](pyrrolidin-1-yl)methanone
Chemical Structure Depiction of
[rel-(3aR,6aR)-2-(5-cyclopropyl-1H-pyrazole-3-carbonyl)-5-(propan-2-yl)hexahydropyrrolo[3,4-c]pyrrol-3a(1H)-yl](pyrrolidin-1-yl)methanone
[rel-(3aR,6aR)-2-(5-cyclopropyl-1H-pyrazole-3-carbonyl)-5-(propan-2-yl)hexahydropyrrolo[3,4-c]pyrrol-3a(1H)-yl](pyrrolidin-1-yl)methanone
Compound characteristics
| Compound ID: | S985-0203 |
| Compound Name: | [rel-(3aR,6aR)-2-(5-cyclopropyl-1H-pyrazole-3-carbonyl)-5-(propan-2-yl)hexahydropyrrolo[3,4-c]pyrrol-3a(1H)-yl](pyrrolidin-1-yl)methanone |
| Molecular Weight: | 385.51 |
| Molecular Formula: | C21 H31 N5 O2 |
| Smiles: | CC(C)N1C[C@H]2CN(C[C@]2(C1)C(N1CCCC1)=O)C(c1cc(C2CC2)[nH]n1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.0614 |
| logD: | -4.0124 |
| logSw: | -2.4644 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.164 |
| InChI Key: | BNOXWEZUAQXHFZ-IERDGZPVSA-N |