3-[4-hydroxy-4-(methoxymethyl)-1-oxa-9-azaspiro[5.5]undecane-9-carbonyl]benzonitrile
Chemical Structure Depiction of
3-[4-hydroxy-4-(methoxymethyl)-1-oxa-9-azaspiro[5.5]undecane-9-carbonyl]benzonitrile
3-[4-hydroxy-4-(methoxymethyl)-1-oxa-9-azaspiro[5.5]undecane-9-carbonyl]benzonitrile
Compound characteristics
| Compound ID: | S835-4864 |
| Compound Name: | 3-[4-hydroxy-4-(methoxymethyl)-1-oxa-9-azaspiro[5.5]undecane-9-carbonyl]benzonitrile |
| Molecular Weight: | 344.41 |
| Molecular Formula: | C19 H24 N2 O4 |
| Smiles: | COCC1(CCOC2(CCN(CC2)C(c2cccc(C#N)c2)=O)C1)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.6957 |
| logD: | 0.6957 |
| logSw: | -1.4159 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.542 |
| InChI Key: | TXDAVYSLVWPRFE-SFHVURJKSA-N |