2-{9-[(4-cyanophenyl)methyl]-1-oxa-9-azaspiro[5.5]undecan-4-yl}-N-methylacetamide
Chemical Structure Depiction of
2-{9-[(4-cyanophenyl)methyl]-1-oxa-9-azaspiro[5.5]undecan-4-yl}-N-methylacetamide
2-{9-[(4-cyanophenyl)methyl]-1-oxa-9-azaspiro[5.5]undecan-4-yl}-N-methylacetamide
Compound characteristics
| Compound ID: | S511-1709 |
| Compound Name: | 2-{9-[(4-cyanophenyl)methyl]-1-oxa-9-azaspiro[5.5]undecan-4-yl}-N-methylacetamide |
| Molecular Weight: | 341.45 |
| Molecular Formula: | C20 H27 N3 O2 |
| Smiles: | CNC(CC1CCOC2(CCN(CC2)Cc2ccc(C#N)cc2)C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.768 |
| logD: | 1.2617 |
| logSw: | -2.3784 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.251 |
| InChI Key: | UGFZMSWCJAICSE-GOSISDBHSA-N |