4-[3-(methoxymethyl)-4-(6-methoxypyridine-3-carbonyl)piperazin-1-yl]-2-(trifluoromethyl)benzonitrile
Chemical Structure Depiction of
4-[3-(methoxymethyl)-4-(6-methoxypyridine-3-carbonyl)piperazin-1-yl]-2-(trifluoromethyl)benzonitrile
4-[3-(methoxymethyl)-4-(6-methoxypyridine-3-carbonyl)piperazin-1-yl]-2-(trifluoromethyl)benzonitrile
Compound characteristics
| Compound ID: | S956-0181 |
| Compound Name: | 4-[3-(methoxymethyl)-4-(6-methoxypyridine-3-carbonyl)piperazin-1-yl]-2-(trifluoromethyl)benzonitrile |
| Molecular Weight: | 434.42 |
| Molecular Formula: | C21 H21 F3 N4 O3 |
| Smiles: | COCC1CN(CCN1C(c1ccc(nc1)OC)=O)c1ccc(C#N)c(c1)C(F)(F)F |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7468 |
| logD: | 2.7468 |
| logSw: | -3.0148 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 61.789 |
| InChI Key: | DXCKZYRFYAOJTG-QGZVFWFLSA-N |