8-[4-cyano-3-(trifluoromethyl)phenyl]-2-(1,3-dimethyl-1H-pyrazole-5-carbonyl)-N-methyl-2,8-diazaspiro[4.5]decane-3-carboxamide
Chemical Structure Depiction of
8-[4-cyano-3-(trifluoromethyl)phenyl]-2-(1,3-dimethyl-1H-pyrazole-5-carbonyl)-N-methyl-2,8-diazaspiro[4.5]decane-3-carboxamide
8-[4-cyano-3-(trifluoromethyl)phenyl]-2-(1,3-dimethyl-1H-pyrazole-5-carbonyl)-N-methyl-2,8-diazaspiro[4.5]decane-3-carboxamide
Compound characteristics
| Compound ID: | S953-0317 |
| Compound Name: | 8-[4-cyano-3-(trifluoromethyl)phenyl]-2-(1,3-dimethyl-1H-pyrazole-5-carbonyl)-N-methyl-2,8-diazaspiro[4.5]decane-3-carboxamide |
| Molecular Weight: | 488.51 |
| Molecular Formula: | C24 H27 F3 N6 O2 |
| Smiles: | Cc1cc(C(N2CC3(CCN(CC3)c3ccc(C#N)c(c3)C(F)(F)F)CC2C(NC)=O)=O)n(C)n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.2299 |
| logD: | 1.2299 |
| logSw: | -2.4558 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.275 |
| InChI Key: | ULXSETOBPXWHDQ-HXUWFJFHSA-N |