3-(4-benzyl-1-oxa-9-azaspiro[5.5]undecane-9-carbonyl)benzonitrile
Chemical Structure Depiction of
3-(4-benzyl-1-oxa-9-azaspiro[5.5]undecane-9-carbonyl)benzonitrile
3-(4-benzyl-1-oxa-9-azaspiro[5.5]undecane-9-carbonyl)benzonitrile
Compound characteristics
| Compound ID: | T500-0219 |
| Compound Name: | 3-(4-benzyl-1-oxa-9-azaspiro[5.5]undecane-9-carbonyl)benzonitrile |
| Molecular Weight: | 374.48 |
| Molecular Formula: | C24 H26 N2 O2 |
| Smiles: | C1COC2(CCN(CC2)C(c2cccc(C#N)c2)=O)CC1Cc1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7657 |
| logD: | 3.7657 |
| logSw: | -4.2659 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 40.273 |
| InChI Key: | XAJXHTWKOQBYPR-FQEVSTJZSA-N |