4-{2-(cyclopent-3-ene-1-carbonyl)-4-[(2-methoxyethoxy)methyl]-2,8-diazaspiro[4.5]decan-8-yl}-2-(trifluoromethyl)benzonitrile
Chemical Structure Depiction of
4-{2-(cyclopent-3-ene-1-carbonyl)-4-[(2-methoxyethoxy)methyl]-2,8-diazaspiro[4.5]decan-8-yl}-2-(trifluoromethyl)benzonitrile
4-{2-(cyclopent-3-ene-1-carbonyl)-4-[(2-methoxyethoxy)methyl]-2,8-diazaspiro[4.5]decan-8-yl}-2-(trifluoromethyl)benzonitrile
Compound characteristics
| Compound ID: | S957-0465 |
| Compound Name: | 4-{2-(cyclopent-3-ene-1-carbonyl)-4-[(2-methoxyethoxy)methyl]-2,8-diazaspiro[4.5]decan-8-yl}-2-(trifluoromethyl)benzonitrile |
| Molecular Weight: | 491.55 |
| Molecular Formula: | C26 H32 F3 N3 O3 |
| Smiles: | COCCOCC1CN(CC12CCN(CC2)c1ccc(C#N)c(c1)C(F)(F)F)C(C1CC=CC1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9753 |
| logD: | 2.9753 |
| logSw: | -3.1674 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 54.61 |
| InChI Key: | VVKRGPIUUCKQOY-OAQYLSRUSA-N |