4-[8-acetyl-4-(hydroxymethyl)-2,8-diazaspiro[4.5]decan-2-yl]-2-(trifluoromethyl)benzonitrile
Chemical Structure Depiction of
4-[8-acetyl-4-(hydroxymethyl)-2,8-diazaspiro[4.5]decan-2-yl]-2-(trifluoromethyl)benzonitrile
4-[8-acetyl-4-(hydroxymethyl)-2,8-diazaspiro[4.5]decan-2-yl]-2-(trifluoromethyl)benzonitrile
Compound characteristics
| Compound ID: | S957-5160 |
| Compound Name: | 4-[8-acetyl-4-(hydroxymethyl)-2,8-diazaspiro[4.5]decan-2-yl]-2-(trifluoromethyl)benzonitrile |
| Molecular Weight: | 381.4 |
| Molecular Formula: | C19 H22 F3 N3 O2 |
| Smiles: | [H]OCC1CN(CC12CCN(CC2)C(C)=O)c1ccc(C#N)c(c1)C(F)(F)F |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.8348 |
| logD: | 1.8348 |
| logSw: | -2.5155 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.211 |
| InChI Key: | UCAAKOPMIHXBNE-HNNXBMFYSA-N |