3-(4-fluorophenyl)-6-methyl-2-{[2-oxo-2-(piperidin-1-yl)ethyl]sulfanyl}-6,7-dihydrothieno[3,2-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
3-(4-fluorophenyl)-6-methyl-2-{[2-oxo-2-(piperidin-1-yl)ethyl]sulfanyl}-6,7-dihydrothieno[3,2-d]pyrimidin-4(3H)-one
3-(4-fluorophenyl)-6-methyl-2-{[2-oxo-2-(piperidin-1-yl)ethyl]sulfanyl}-6,7-dihydrothieno[3,2-d]pyrimidin-4(3H)-one
Compound characteristics
Compound ID: | C280-1058 |
Compound Name: | 3-(4-fluorophenyl)-6-methyl-2-{[2-oxo-2-(piperidin-1-yl)ethyl]sulfanyl}-6,7-dihydrothieno[3,2-d]pyrimidin-4(3H)-one |
Molecular Weight: | 419.54 |
Molecular Formula: | C20 H22 F N3 O2 S2 |
Smiles: | CC1CC2=C(C(N(C(=N2)SCC(N2CCCCC2)=O)c2ccc(cc2)F)=O)S1 |
Stereo: | RACEMIC MIXTURE |
logP: | 2.9577 |
logD: | 2.9576 |
logSw: | -3.1607 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 41.889 |
InChI Key: | OGMHOFRJGGDDMB-ZDUSSCGKSA-N |