4-[3-(methoxymethyl)-4-(6-methylpyridine-3-carbonyl)piperazin-1-yl]-2-(trifluoromethyl)benzonitrile
Chemical Structure Depiction of
4-[3-(methoxymethyl)-4-(6-methylpyridine-3-carbonyl)piperazin-1-yl]-2-(trifluoromethyl)benzonitrile
4-[3-(methoxymethyl)-4-(6-methylpyridine-3-carbonyl)piperazin-1-yl]-2-(trifluoromethyl)benzonitrile
Compound characteristics
Compound ID: | S956-0170 |
Compound Name: | 4-[3-(methoxymethyl)-4-(6-methylpyridine-3-carbonyl)piperazin-1-yl]-2-(trifluoromethyl)benzonitrile |
Molecular Weight: | 418.42 |
Molecular Formula: | C21 H21 F3 N4 O2 |
Smiles: | Cc1ccc(cn1)C(N1CCN(CC1COC)c1ccc(C#N)c(c1)C(F)(F)F)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 2.6275 |
logD: | 2.6274 |
logSw: | -2.8343 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 54.151 |
InChI Key: | SZISDWQZAWLMBA-GOSISDBHSA-N |