1-[rel-(3aR,6aR)-5-(1-ethyl-1H-pyrazole-5-carbonyl)-3a-(pyrrolidine-1-carbonyl)hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl]ethan-1-one
Chemical Structure Depiction of
1-[rel-(3aR,6aR)-5-(1-ethyl-1H-pyrazole-5-carbonyl)-3a-(pyrrolidine-1-carbonyl)hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl]ethan-1-one
1-[rel-(3aR,6aR)-5-(1-ethyl-1H-pyrazole-5-carbonyl)-3a-(pyrrolidine-1-carbonyl)hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl]ethan-1-one
Compound characteristics
| Compound ID: | S985-0394 |
| Compound Name: | 1-[rel-(3aR,6aR)-5-(1-ethyl-1H-pyrazole-5-carbonyl)-3a-(pyrrolidine-1-carbonyl)hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl]ethan-1-one |
| Molecular Weight: | 373.45 |
| Molecular Formula: | C19 H27 N5 O3 |
| Smiles: | CCn1c(ccn1)C(N1C[C@@H]2CN(C[C@@]2(C1)C(N1CCCC1)=O)C(C)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | -0.0869 |
| logD: | -0.0869 |
| logSw: | -1.1121 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 64.572 |
| InChI Key: | UFRFOCVLZFCKFB-BEFAXECRSA-N |