4-[2-butanoyl-3-(pyrrolidine-1-carbonyl)-2,8-diazaspiro[4.5]decan-8-yl]-2-(trifluoromethyl)benzonitrile
Chemical Structure Depiction of
4-[2-butanoyl-3-(pyrrolidine-1-carbonyl)-2,8-diazaspiro[4.5]decan-8-yl]-2-(trifluoromethyl)benzonitrile
4-[2-butanoyl-3-(pyrrolidine-1-carbonyl)-2,8-diazaspiro[4.5]decan-8-yl]-2-(trifluoromethyl)benzonitrile
Compound characteristics
| Compound ID: | S953-0618 |
| Compound Name: | 4-[2-butanoyl-3-(pyrrolidine-1-carbonyl)-2,8-diazaspiro[4.5]decan-8-yl]-2-(trifluoromethyl)benzonitrile |
| Molecular Weight: | 476.54 |
| Molecular Formula: | C25 H31 F3 N4 O2 |
| Smiles: | CCCC(N1CC2(CCN(CC2)c2ccc(C#N)c(c2)C(F)(F)F)CC1C(N1CCCC1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.547 |
| logD: | 3.547 |
| logSw: | -3.7874 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 53.876 |
| InChI Key: | FMSGQOMQDJYQDE-OAQYLSRUSA-N |