8-[4-cyano-3-(trifluoromethyl)phenyl]-N-methyl-2-{[1-(propan-2-yl)-1H-pyrazol-4-yl]methyl}-2,8-diazaspiro[4.5]decane-4-carboxamide
Chemical Structure Depiction of
8-[4-cyano-3-(trifluoromethyl)phenyl]-N-methyl-2-{[1-(propan-2-yl)-1H-pyrazol-4-yl]methyl}-2,8-diazaspiro[4.5]decane-4-carboxamide
8-[4-cyano-3-(trifluoromethyl)phenyl]-N-methyl-2-{[1-(propan-2-yl)-1H-pyrazol-4-yl]methyl}-2,8-diazaspiro[4.5]decane-4-carboxamide
Compound characteristics
Compound ID: | S952-0321 |
Compound Name: | 8-[4-cyano-3-(trifluoromethyl)phenyl]-N-methyl-2-{[1-(propan-2-yl)-1H-pyrazol-4-yl]methyl}-2,8-diazaspiro[4.5]decane-4-carboxamide |
Molecular Weight: | 488.56 |
Molecular Formula: | C25 H31 F3 N6 O |
Smiles: | CC(C)n1cc(CN2CC(C(NC)=O)C3(CCN(CC3)c3ccc(C#N)c(c3)C(F)(F)F)C2)cn1 |
Stereo: | RACEMIC MIXTURE |
logP: | 1.972 |
logD: | -6.0142 |
logSw: | -2.8027 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 64.238 |
InChI Key: | FOUGEGIBIKYTMZ-JOCHJYFZSA-N |