4-[8-(2,5-dimethylfuran-3-carbonyl)-4-(methoxymethyl)-2,8-diazaspiro[4.5]decan-2-yl]-2-(trifluoromethyl)benzonitrile
Chemical Structure Depiction of
4-[8-(2,5-dimethylfuran-3-carbonyl)-4-(methoxymethyl)-2,8-diazaspiro[4.5]decan-2-yl]-2-(trifluoromethyl)benzonitrile
4-[8-(2,5-dimethylfuran-3-carbonyl)-4-(methoxymethyl)-2,8-diazaspiro[4.5]decan-2-yl]-2-(trifluoromethyl)benzonitrile
Compound characteristics
| Compound ID: | S957-5219 |
| Compound Name: | 4-[8-(2,5-dimethylfuran-3-carbonyl)-4-(methoxymethyl)-2,8-diazaspiro[4.5]decan-2-yl]-2-(trifluoromethyl)benzonitrile |
| Molecular Weight: | 475.51 |
| Molecular Formula: | C25 H28 F3 N3 O3 |
| Smiles: | Cc1cc(C(N2CCC3(CC2)CN(CC3COC)c2ccc(C#N)c(c2)C(F)(F)F)=O)c(C)o1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5297 |
| logD: | 3.5297 |
| logSw: | -3.5975 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 53.528 |
| InChI Key: | DHIXCYJMVPSGRH-IBGZPJMESA-N |