2-{1-[4-(2-fluorophenyl)piperazin-1-yl]-1-oxobutan-2-yl}-4-methyl[1]benzothieno[2,3-d]pyridazin-1(2H)-one
Chemical Structure Depiction of
2-{1-[4-(2-fluorophenyl)piperazin-1-yl]-1-oxobutan-2-yl}-4-methyl[1]benzothieno[2,3-d]pyridazin-1(2H)-one
2-{1-[4-(2-fluorophenyl)piperazin-1-yl]-1-oxobutan-2-yl}-4-methyl[1]benzothieno[2,3-d]pyridazin-1(2H)-one
Compound characteristics
Compound ID: | E019-0631 |
Compound Name: | 2-{1-[4-(2-fluorophenyl)piperazin-1-yl]-1-oxobutan-2-yl}-4-methyl[1]benzothieno[2,3-d]pyridazin-1(2H)-one |
Molecular Weight: | 464.56 |
Molecular Formula: | C25 H25 F N4 O2 S |
Smiles: | CCC(C(N1CCN(CC1)c1ccccc1F)=O)N1C(c2c3ccccc3sc2C(C)=N1)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 4.8906 |
logD: | 4.8906 |
logSw: | -4.8853 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 45.384 |
InChI Key: | ZWCSXTCGDGOAQD-IBGZPJMESA-N |