4-{4-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-1-oxa-9-azaspiro[5.5]undecane-9-carbonyl}benzonitrile
Chemical Structure Depiction of
4-{4-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-1-oxa-9-azaspiro[5.5]undecane-9-carbonyl}benzonitrile
4-{4-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-1-oxa-9-azaspiro[5.5]undecane-9-carbonyl}benzonitrile
Compound characteristics
| Compound ID: | S511-1006 |
| Compound Name: | 4-{4-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-1-oxa-9-azaspiro[5.5]undecane-9-carbonyl}benzonitrile |
| Molecular Weight: | 395.5 |
| Molecular Formula: | C23 H29 N3 O3 |
| Smiles: | C1CCN(C1)C(CC1CCOC2(CCN(CC2)C(c2ccc(C#N)cc2)=O)C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0643 |
| logD: | 2.0643 |
| logSw: | -2.4228 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 57.032 |
| InChI Key: | GAPQTIOUKKZKIC-IBGZPJMESA-N |