4-{8-[(3,5-dimethyl-1H-pyrazol-1-yl)acetyl]-4-(hydroxymethyl)-2,8-diazaspiro[4.5]decan-2-yl}-2-(trifluoromethyl)benzonitrile
Chemical Structure Depiction of
4-{8-[(3,5-dimethyl-1H-pyrazol-1-yl)acetyl]-4-(hydroxymethyl)-2,8-diazaspiro[4.5]decan-2-yl}-2-(trifluoromethyl)benzonitrile
4-{8-[(3,5-dimethyl-1H-pyrazol-1-yl)acetyl]-4-(hydroxymethyl)-2,8-diazaspiro[4.5]decan-2-yl}-2-(trifluoromethyl)benzonitrile
Compound characteristics
| Compound ID: | S957-5154 |
| Compound Name: | 4-{8-[(3,5-dimethyl-1H-pyrazol-1-yl)acetyl]-4-(hydroxymethyl)-2,8-diazaspiro[4.5]decan-2-yl}-2-(trifluoromethyl)benzonitrile |
| Molecular Weight: | 475.51 |
| Molecular Formula: | C24 H28 F3 N5 O2 |
| Smiles: | [H]OCC1CN(CC12CCN(CC2)C(Cn1c(C)cc(C)n1)=O)c1ccc(C#N)c(c1)C(F)(F)F |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.432 |
| logD: | 1.432 |
| logSw: | -2.2645 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.951 |
| InChI Key: | AHFAMPCTACGPCA-IBGZPJMESA-N |