4-[8-butanoyl-4-(pyrrolidine-1-carbonyl)-2,8-diazaspiro[4.5]decan-2-yl]-2-(trifluoromethyl)benzonitrile
Chemical Structure Depiction of
4-[8-butanoyl-4-(pyrrolidine-1-carbonyl)-2,8-diazaspiro[4.5]decan-2-yl]-2-(trifluoromethyl)benzonitrile
4-[8-butanoyl-4-(pyrrolidine-1-carbonyl)-2,8-diazaspiro[4.5]decan-2-yl]-2-(trifluoromethyl)benzonitrile
Compound characteristics
| Compound ID: | S952-5488 |
| Compound Name: | 4-[8-butanoyl-4-(pyrrolidine-1-carbonyl)-2,8-diazaspiro[4.5]decan-2-yl]-2-(trifluoromethyl)benzonitrile |
| Molecular Weight: | 476.54 |
| Molecular Formula: | C25 H31 F3 N4 O2 |
| Smiles: | CCCC(N1CCC2(CC1)CN(CC2C(N1CCCC1)=O)c1ccc(C#N)c(c1)C(F)(F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1118 |
| logD: | 3.1118 |
| logSw: | -3.2275 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 54.115 |
| InChI Key: | LFCYOPNKGUQLMV-NRFANRHFSA-N |