8-[4-cyano-3-(trifluoromethyl)phenyl]-2-(1,3,5-trimethyl-1H-pyrazole-4-carbonyl)-2,8-diazaspiro[4.5]decane-3-carboxamide
Chemical Structure Depiction of
8-[4-cyano-3-(trifluoromethyl)phenyl]-2-(1,3,5-trimethyl-1H-pyrazole-4-carbonyl)-2,8-diazaspiro[4.5]decane-3-carboxamide
8-[4-cyano-3-(trifluoromethyl)phenyl]-2-(1,3,5-trimethyl-1H-pyrazole-4-carbonyl)-2,8-diazaspiro[4.5]decane-3-carboxamide
Compound characteristics
| Compound ID: | S953-0177 |
| Compound Name: | 8-[4-cyano-3-(trifluoromethyl)phenyl]-2-(1,3,5-trimethyl-1H-pyrazole-4-carbonyl)-2,8-diazaspiro[4.5]decane-3-carboxamide |
| Molecular Weight: | 488.51 |
| Molecular Formula: | C24 H27 F3 N6 O2 |
| Smiles: | Cc1c(C(N2CC3(CCN(CC3)c3ccc(C#N)c(c3)C(F)(F)F)CC2C(N)=O)=O)c(C)n(C)n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.891 |
| logD: | 0.891 |
| logSw: | -2.3856 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.016 |
| InChI Key: | LEKFDYOQDZXCRY-LJQANCHMSA-N |