8-[4-cyano-3-(trifluoromethyl)phenyl]-2-(2,5-dimethylfuran-3-carbonyl)-N-methyl-2,8-diazaspiro[4.5]decane-4-carboxamide
Chemical Structure Depiction of
8-[4-cyano-3-(trifluoromethyl)phenyl]-2-(2,5-dimethylfuran-3-carbonyl)-N-methyl-2,8-diazaspiro[4.5]decane-4-carboxamide
8-[4-cyano-3-(trifluoromethyl)phenyl]-2-(2,5-dimethylfuran-3-carbonyl)-N-methyl-2,8-diazaspiro[4.5]decane-4-carboxamide
Compound characteristics
| Compound ID: | S952-0188 |
| Compound Name: | 8-[4-cyano-3-(trifluoromethyl)phenyl]-2-(2,5-dimethylfuran-3-carbonyl)-N-methyl-2,8-diazaspiro[4.5]decane-4-carboxamide |
| Molecular Weight: | 488.51 |
| Molecular Formula: | C25 H27 F3 N4 O3 |
| Smiles: | Cc1cc(C(N2CC(C(NC)=O)C3(CCN(CC3)c3ccc(C#N)c(c3)C(F)(F)F)C2)=O)c(C)o1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3245 |
| logD: | 2.3245 |
| logSw: | -3.0022 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.939 |
| InChI Key: | HOWQSXSOILCZPR-OAQYLSRUSA-N |