4-[3-(methoxymethyl)-4-(thiophene-3-carbonyl)piperazin-1-yl]-2-(trifluoromethyl)benzonitrile
Chemical Structure Depiction of
4-[3-(methoxymethyl)-4-(thiophene-3-carbonyl)piperazin-1-yl]-2-(trifluoromethyl)benzonitrile
4-[3-(methoxymethyl)-4-(thiophene-3-carbonyl)piperazin-1-yl]-2-(trifluoromethyl)benzonitrile
Compound characteristics
| Compound ID: | S956-0172 |
| Compound Name: | 4-[3-(methoxymethyl)-4-(thiophene-3-carbonyl)piperazin-1-yl]-2-(trifluoromethyl)benzonitrile |
| Molecular Weight: | 409.43 |
| Molecular Formula: | C19 H18 F3 N3 O2 S |
| Smiles: | COCC1CN(CCN1C(c1ccsc1)=O)c1ccc(C#N)c(c1)C(F)(F)F |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.098 |
| logD: | 3.098 |
| logSw: | -3.3297 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 46.225 |
| InChI Key: | NYOZCVHIBLIKHR-MRXNPFEDSA-N |