8-[4-cyano-3-(trifluoromethyl)phenyl]-2-(4-methyl-1,3-oxazole-5-carbonyl)-2,8-diazaspiro[4.5]decane-4-carboxamide
Chemical Structure Depiction of
8-[4-cyano-3-(trifluoromethyl)phenyl]-2-(4-methyl-1,3-oxazole-5-carbonyl)-2,8-diazaspiro[4.5]decane-4-carboxamide
8-[4-cyano-3-(trifluoromethyl)phenyl]-2-(4-methyl-1,3-oxazole-5-carbonyl)-2,8-diazaspiro[4.5]decane-4-carboxamide
Compound characteristics
Compound ID: | S952-0075 |
Compound Name: | 8-[4-cyano-3-(trifluoromethyl)phenyl]-2-(4-methyl-1,3-oxazole-5-carbonyl)-2,8-diazaspiro[4.5]decane-4-carboxamide |
Molecular Weight: | 461.44 |
Molecular Formula: | C22 H22 F3 N5 O3 |
Smiles: | Cc1c(C(N2CC(C(N)=O)C3(CCN(CC3)c3ccc(C#N)c(c3)C(F)(F)F)C2)=O)ocn1 |
Stereo: | RACEMIC MIXTURE |
logP: | 0.8696 |
logD: | 0.8696 |
logSw: | -2.21 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 90.33 |
InChI Key: | XIVHYUPTFIJQGK-QGZVFWFLSA-N |