8-[4-cyano-3-(trifluoromethyl)phenyl]-2-(5-methylthiophene-2-carbonyl)-2,8-diazaspiro[4.5]decane-3-carboxamide
Chemical Structure Depiction of
8-[4-cyano-3-(trifluoromethyl)phenyl]-2-(5-methylthiophene-2-carbonyl)-2,8-diazaspiro[4.5]decane-3-carboxamide
8-[4-cyano-3-(trifluoromethyl)phenyl]-2-(5-methylthiophene-2-carbonyl)-2,8-diazaspiro[4.5]decane-3-carboxamide
Compound characteristics
Compound ID: | S953-0038 |
Compound Name: | 8-[4-cyano-3-(trifluoromethyl)phenyl]-2-(5-methylthiophene-2-carbonyl)-2,8-diazaspiro[4.5]decane-3-carboxamide |
Molecular Weight: | 476.52 |
Molecular Formula: | C23 H23 F3 N4 O2 S |
Smiles: | Cc1ccc(C(N2CC3(CCN(CC3)c3ccc(C#N)c(c3)C(F)(F)F)CC2C(N)=O)=O)s1 |
Stereo: | RACEMIC MIXTURE |
logP: | 3.1487 |
logD: | 3.1487 |
logSw: | -3.3404 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 72.195 |
InChI Key: | MDMLGKVWZHBSPJ-SFHVURJKSA-N |