3-({4-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-1-oxa-9-azaspiro[5.5]undecan-9-yl}methyl)benzonitrile
Chemical Structure Depiction of
3-({4-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-1-oxa-9-azaspiro[5.5]undecan-9-yl}methyl)benzonitrile
3-({4-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-1-oxa-9-azaspiro[5.5]undecan-9-yl}methyl)benzonitrile
Compound characteristics
| Compound ID: | S511-1140 |
| Compound Name: | 3-({4-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-1-oxa-9-azaspiro[5.5]undecan-9-yl}methyl)benzonitrile |
| Molecular Weight: | 381.52 |
| Molecular Formula: | C23 H31 N3 O2 |
| Smiles: | C1CCN(C1)C(CC1CCOC2(CCN(CC2)Cc2cccc(C#N)c2)C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7729 |
| logD: | 2.6341 |
| logSw: | -2.9577 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 44.116 |
| InChI Key: | JVQKJDRMPCFHCD-LJQANCHMSA-N |