4-{2-[(1-ethyl-1H-pyrazol-4-yl)methyl]-4-(hydroxymethyl)-2,8-diazaspiro[4.5]decan-8-yl}-2-(trifluoromethyl)benzonitrile
Chemical Structure Depiction of
4-{2-[(1-ethyl-1H-pyrazol-4-yl)methyl]-4-(hydroxymethyl)-2,8-diazaspiro[4.5]decan-8-yl}-2-(trifluoromethyl)benzonitrile
4-{2-[(1-ethyl-1H-pyrazol-4-yl)methyl]-4-(hydroxymethyl)-2,8-diazaspiro[4.5]decan-8-yl}-2-(trifluoromethyl)benzonitrile
Compound characteristics
| Compound ID: | S957-0167 |
| Compound Name: | 4-{2-[(1-ethyl-1H-pyrazol-4-yl)methyl]-4-(hydroxymethyl)-2,8-diazaspiro[4.5]decan-8-yl}-2-(trifluoromethyl)benzonitrile |
| Molecular Weight: | 447.5 |
| Molecular Formula: | C23 H28 F3 N5 O |
| Smiles: | [H]OCC1CN(Cc2cnn(CC)c2)CC12CCN(CC2)c1ccc(C#N)c(c1)C(F)(F)F |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0749 |
| logD: | -5.8737 |
| logSw: | -2.1939 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.058 |
| InChI Key: | IIDCMFCNCQTSKS-LJQANCHMSA-N |