3-[4-(2-hydroxyethyl)-1-oxa-9-azaspiro[5.5]undecane-9-carbonyl]benzonitrile
Chemical Structure Depiction of
3-[4-(2-hydroxyethyl)-1-oxa-9-azaspiro[5.5]undecane-9-carbonyl]benzonitrile
3-[4-(2-hydroxyethyl)-1-oxa-9-azaspiro[5.5]undecane-9-carbonyl]benzonitrile
Compound characteristics
| Compound ID: | S726-0054 |
| Compound Name: | 3-[4-(2-hydroxyethyl)-1-oxa-9-azaspiro[5.5]undecane-9-carbonyl]benzonitrile |
| Molecular Weight: | 328.41 |
| Molecular Formula: | C19 H24 N2 O3 |
| Smiles: | C(CO)C1CCOC2(CCN(CC2)C(c2cccc(C#N)c2)=O)C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.3154 |
| logD: | 1.3154 |
| logSw: | -1.7618 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.2 |
| InChI Key: | SLXHOSDJSRMYHF-OAHLLOKOSA-N |