{4-[4-(2H-1,3-benzodioxol-5-yl)pyrimidin-2-yl]piperazin-1-yl}(2,3,5,6-tetrafluorophenyl)methanone
Chemical Structure Depiction of
{4-[4-(2H-1,3-benzodioxol-5-yl)pyrimidin-2-yl]piperazin-1-yl}(2,3,5,6-tetrafluorophenyl)methanone
{4-[4-(2H-1,3-benzodioxol-5-yl)pyrimidin-2-yl]piperazin-1-yl}(2,3,5,6-tetrafluorophenyl)methanone
Compound characteristics
| Compound ID: | V007-0564 |
| Compound Name: | {4-[4-(2H-1,3-benzodioxol-5-yl)pyrimidin-2-yl]piperazin-1-yl}(2,3,5,6-tetrafluorophenyl)methanone |
| Molecular Weight: | 460.39 |
| Molecular Formula: | C22 H16 F4 N4 O3 |
| Salt: | not_available |
| Smiles: | C1CN(CCN1C(c1c(c(cc(c1F)F)F)F)=O)c1nccc(c2ccc3c(c2)OCO3)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.4952 |
| logD: | 4.4945 |
| logSw: | -4.6709 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 54.921 |
| InChI Key: | MNVUMZYHUIGTIF-UHFFFAOYSA-N |