4-[4-(2,6-dimethoxypyridine-3-carbonyl)-2-(methoxymethyl)piperazin-1-yl]-2-(trifluoromethyl)benzonitrile
Chemical Structure Depiction of
4-[4-(2,6-dimethoxypyridine-3-carbonyl)-2-(methoxymethyl)piperazin-1-yl]-2-(trifluoromethyl)benzonitrile
4-[4-(2,6-dimethoxypyridine-3-carbonyl)-2-(methoxymethyl)piperazin-1-yl]-2-(trifluoromethyl)benzonitrile
Compound characteristics
| Compound ID: | S956-5141 |
| Compound Name: | 4-[4-(2,6-dimethoxypyridine-3-carbonyl)-2-(methoxymethyl)piperazin-1-yl]-2-(trifluoromethyl)benzonitrile |
| Molecular Weight: | 464.44 |
| Molecular Formula: | C22 H23 F3 N4 O4 |
| Smiles: | COCC1CN(CCN1c1ccc(C#N)c(c1)C(F)(F)F)C(c1ccc(nc1OC)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3858 |
| logD: | 3.3858 |
| logSw: | -3.7007 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 69.568 |
| InChI Key: | LQRIQSHOZDDBEV-MRXNPFEDSA-N |