4-{4-(hydroxymethyl)-2-[(1H-indol-3-yl)methyl]-2,8-diazaspiro[4.5]decan-8-yl}-2-(trifluoromethyl)benzonitrile
Chemical Structure Depiction of
4-{4-(hydroxymethyl)-2-[(1H-indol-3-yl)methyl]-2,8-diazaspiro[4.5]decan-8-yl}-2-(trifluoromethyl)benzonitrile
4-{4-(hydroxymethyl)-2-[(1H-indol-3-yl)methyl]-2,8-diazaspiro[4.5]decan-8-yl}-2-(trifluoromethyl)benzonitrile
Compound characteristics
| Compound ID: | S957-0054 |
| Compound Name: | 4-{4-(hydroxymethyl)-2-[(1H-indol-3-yl)methyl]-2,8-diazaspiro[4.5]decan-8-yl}-2-(trifluoromethyl)benzonitrile |
| Molecular Weight: | 468.52 |
| Molecular Formula: | C26 H27 F3 N4 O |
| Smiles: | [H]OCC1CN(Cc2c[nH]c3ccccc23)CC12CCN(CC2)c1ccc(C#N)c(c1)C(F)(F)F |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7482 |
| logD: | -0.926 |
| logSw: | -4.1239 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 51.427 |
| InChI Key: | PYAQZBCJVQOKDW-HXUWFJFHSA-N |