4-[3-(methoxymethyl)-4-(5-methylthiophene-2-carbonyl)piperazin-1-yl]-2-(trifluoromethyl)benzonitrile
Chemical Structure Depiction of
4-[3-(methoxymethyl)-4-(5-methylthiophene-2-carbonyl)piperazin-1-yl]-2-(trifluoromethyl)benzonitrile
4-[3-(methoxymethyl)-4-(5-methylthiophene-2-carbonyl)piperazin-1-yl]-2-(trifluoromethyl)benzonitrile
Compound characteristics
| Compound ID: | S956-0159 |
| Compound Name: | 4-[3-(methoxymethyl)-4-(5-methylthiophene-2-carbonyl)piperazin-1-yl]-2-(trifluoromethyl)benzonitrile |
| Molecular Weight: | 423.46 |
| Molecular Formula: | C20 H20 F3 N3 O2 S |
| Smiles: | Cc1ccc(C(N2CCN(CC2COC)c2ccc(C#N)c(c2)C(F)(F)F)=O)s1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8503 |
| logD: | 3.8503 |
| logSw: | -3.9963 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 46.225 |
| InChI Key: | SGDCMUAWLIVRHF-MRXNPFEDSA-N |