4-({4-[2-(morpholin-4-yl)-2-oxoethyl]-1-oxa-9-azaspiro[5.5]undecan-9-yl}methyl)benzonitrile
Chemical Structure Depiction of
4-({4-[2-(morpholin-4-yl)-2-oxoethyl]-1-oxa-9-azaspiro[5.5]undecan-9-yl}methyl)benzonitrile
4-({4-[2-(morpholin-4-yl)-2-oxoethyl]-1-oxa-9-azaspiro[5.5]undecan-9-yl}methyl)benzonitrile
Compound characteristics
| Compound ID: | S511-0851 |
| Compound Name: | 4-({4-[2-(morpholin-4-yl)-2-oxoethyl]-1-oxa-9-azaspiro[5.5]undecan-9-yl}methyl)benzonitrile |
| Molecular Weight: | 397.52 |
| Molecular Formula: | C23 H31 N3 O3 |
| Smiles: | C1COC2(CCN(CC2)Cc2ccc(C#N)cc2)CC1CC(N1CCOCC1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.9131 |
| logD: | 1.4068 |
| logSw: | -2.3179 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 51.659 |
| InChI Key: | VLWRMBBLFKMNFB-OAQYLSRUSA-N |