4-[3-(methoxymethyl)-4-(2-methylfuran-3-carbonyl)piperazin-1-yl]-2-(trifluoromethyl)benzonitrile
Chemical Structure Depiction of
4-[3-(methoxymethyl)-4-(2-methylfuran-3-carbonyl)piperazin-1-yl]-2-(trifluoromethyl)benzonitrile
4-[3-(methoxymethyl)-4-(2-methylfuran-3-carbonyl)piperazin-1-yl]-2-(trifluoromethyl)benzonitrile
Compound characteristics
| Compound ID: | S956-0183 |
| Compound Name: | 4-[3-(methoxymethyl)-4-(2-methylfuran-3-carbonyl)piperazin-1-yl]-2-(trifluoromethyl)benzonitrile |
| Molecular Weight: | 407.39 |
| Molecular Formula: | C20 H20 F3 N3 O3 |
| Smiles: | Cc1c(cco1)C(N1CCN(CC1COC)c1ccc(C#N)c(c1)C(F)(F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7385 |
| logD: | 2.7385 |
| logSw: | -3.0373 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 53.44 |
| InChI Key: | KWRLCOLLAVLANS-MRXNPFEDSA-N |