4-{4-(hydroxymethyl)-8-[(1H-indol-3-yl)acetyl]-2,8-diazaspiro[4.5]decan-2-yl}-2-(trifluoromethyl)benzonitrile
Chemical Structure Depiction of
4-{4-(hydroxymethyl)-8-[(1H-indol-3-yl)acetyl]-2,8-diazaspiro[4.5]decan-2-yl}-2-(trifluoromethyl)benzonitrile
4-{4-(hydroxymethyl)-8-[(1H-indol-3-yl)acetyl]-2,8-diazaspiro[4.5]decan-2-yl}-2-(trifluoromethyl)benzonitrile
Compound characteristics
| Compound ID: | S957-5056 |
| Compound Name: | 4-{4-(hydroxymethyl)-8-[(1H-indol-3-yl)acetyl]-2,8-diazaspiro[4.5]decan-2-yl}-2-(trifluoromethyl)benzonitrile |
| Molecular Weight: | 496.53 |
| Molecular Formula: | C27 H27 F3 N4 O2 |
| Smiles: | [H]OCC1CN(CC12CCN(CC2)C(Cc1c[nH]c2ccccc12)=O)c1ccc(C#N)c(c1)C(F)(F)F |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4211 |
| logD: | 3.4211 |
| logSw: | -3.6905 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.815 |
| InChI Key: | VMGMQAWBOMGJSF-HXUWFJFHSA-N |