4-[4-(6-methylpyridine-3-carbonyl)-3-(phenoxymethyl)piperazin-1-yl]-2-(trifluoromethyl)benzonitrile
Chemical Structure Depiction of
4-[4-(6-methylpyridine-3-carbonyl)-3-(phenoxymethyl)piperazin-1-yl]-2-(trifluoromethyl)benzonitrile
4-[4-(6-methylpyridine-3-carbonyl)-3-(phenoxymethyl)piperazin-1-yl]-2-(trifluoromethyl)benzonitrile
Compound characteristics
| Compound ID: | S956-0371 |
| Compound Name: | 4-[4-(6-methylpyridine-3-carbonyl)-3-(phenoxymethyl)piperazin-1-yl]-2-(trifluoromethyl)benzonitrile |
| Molecular Weight: | 480.49 |
| Molecular Formula: | C26 H23 F3 N4 O2 |
| Smiles: | Cc1ccc(cn1)C(N1CCN(CC1COc1ccccc1)c1ccc(C#N)c(c1)C(F)(F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2858 |
| logD: | 4.2857 |
| logSw: | -4.1665 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 52.954 |
| InChI Key: | FOTAOCJEYKGNQO-JOCHJYFZSA-N |