4-[2-acetyl-3-(pyrrolidine-1-carbonyl)-2,8-diazaspiro[4.5]decan-8-yl]-2-(trifluoromethyl)benzonitrile
Chemical Structure Depiction of
4-[2-acetyl-3-(pyrrolidine-1-carbonyl)-2,8-diazaspiro[4.5]decan-8-yl]-2-(trifluoromethyl)benzonitrile
4-[2-acetyl-3-(pyrrolidine-1-carbonyl)-2,8-diazaspiro[4.5]decan-8-yl]-2-(trifluoromethyl)benzonitrile
Compound characteristics
| Compound ID: | S953-0621 |
| Compound Name: | 4-[2-acetyl-3-(pyrrolidine-1-carbonyl)-2,8-diazaspiro[4.5]decan-8-yl]-2-(trifluoromethyl)benzonitrile |
| Molecular Weight: | 448.49 |
| Molecular Formula: | C23 H27 F3 N4 O2 |
| Smiles: | CC(N1CC2(CCN(CC2)c2ccc(C#N)c(c2)C(F)(F)F)CC1C(N1CCCC1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2993 |
| logD: | 2.2993 |
| logSw: | -3.0311 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 54.871 |
| InChI Key: | NUIQEKXMRZMDSF-HXUWFJFHSA-N |