4-[2-(methoxymethyl)-4-(2-methylfuran-3-carbonyl)piperazin-1-yl]-2-(trifluoromethyl)benzonitrile
Chemical Structure Depiction of
4-[2-(methoxymethyl)-4-(2-methylfuran-3-carbonyl)piperazin-1-yl]-2-(trifluoromethyl)benzonitrile
4-[2-(methoxymethyl)-4-(2-methylfuran-3-carbonyl)piperazin-1-yl]-2-(trifluoromethyl)benzonitrile
Compound characteristics
| Compound ID: | S956-5199 |
| Compound Name: | 4-[2-(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(C(C1)COC)c1ccc(C#N)c(c1)C(F)(F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6419 |
| logD: | 2.6419 |
| logSw: | -2.9807 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 53.44 |
| InChI Key: | QHKCWTXOIMHSIT-MRXNPFEDSA-N |