4-{4-[(benzyloxy)acetyl]-2-(methoxymethyl)piperazin-1-yl}-2-(trifluoromethyl)benzonitrile
Chemical Structure Depiction of
4-{4-[(benzyloxy)acetyl]-2-(methoxymethyl)piperazin-1-yl}-2-(trifluoromethyl)benzonitrile
4-{4-[(benzyloxy)acetyl]-2-(methoxymethyl)piperazin-1-yl}-2-(trifluoromethyl)benzonitrile
Compound characteristics
| Compound ID: | S956-5272 |
| Compound Name: | 4-{4-[(benzyloxy)acetyl]-2-(methoxymethyl)piperazin-1-yl}-2-(trifluoromethyl)benzonitrile |
| Molecular Weight: | 447.46 |
| Molecular Formula: | C23 H24 F3 N3 O3 |
| Smiles: | COCC1CN(CCN1c1ccc(C#N)c(c1)C(F)(F)F)C(COCc1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9604 |
| logD: | 2.9604 |
| logSw: | -3.3434 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 53.114 |
| InChI Key: | GHQFWZVUZPLVDT-HXUWFJFHSA-N |