4-(2H-1,3-benzodioxol-5-yl)-2-[4-(2,3,4,5,6-pentafluorobenzene-1-sulfonyl)piperazin-1-yl]pyrimidine
Chemical Structure Depiction of
4-(2H-1,3-benzodioxol-5-yl)-2-[4-(2,3,4,5,6-pentafluorobenzene-1-sulfonyl)piperazin-1-yl]pyrimidine
4-(2H-1,3-benzodioxol-5-yl)-2-[4-(2,3,4,5,6-pentafluorobenzene-1-sulfonyl)piperazin-1-yl]pyrimidine
Compound characteristics
| Compound ID: | V008-6202 |
| Compound Name: | 4-(2H-1,3-benzodioxol-5-yl)-2-[4-(2,3,4,5,6-pentafluorobenzene-1-sulfonyl)piperazin-1-yl]pyrimidine |
| Molecular Weight: | 514.43 |
| Molecular Formula: | C21 H15 F5 N4 O4 S |
| Salt: | not_available |
| Smiles: | C1CN(CCN1c1nccc(c2ccc3c(c2)OCO3)n1)S(c1c(c(c(c(c1F)F)F)F)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2366 |
| logD: | 4.2345 |
| logSw: | -4.462 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 69.984 |
| InChI Key: | OQEYDKOQTRQYSG-UHFFFAOYSA-N |