3-(4-ethoxyphenyl)-5-{[(4-fluorophenyl)methyl]sulfanyl}-6-methyl-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Chemical Structure Depiction of
3-(4-ethoxyphenyl)-5-{[(4-fluorophenyl)methyl]sulfanyl}-6-methyl-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
3-(4-ethoxyphenyl)-5-{[(4-fluorophenyl)methyl]sulfanyl}-6-methyl-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Compound characteristics
Compound ID: | F143-0383 |
Compound Name: | 3-(4-ethoxyphenyl)-5-{[(4-fluorophenyl)methyl]sulfanyl}-6-methyl-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one |
Molecular Weight: | 459.58 |
Molecular Formula: | C21 H18 F N3 O2 S3 |
Smiles: | CCOc1ccc(cc1)N1C2=C(C(N(C)C(=N2)SCc2ccc(cc2)F)=O)SC1=S |
Stereo: | ACHIRAL |
logP: | 4.253 |
logD: | 4.253 |
logSw: | -4.1256 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 34.727 |
InChI Key: | MEMNJZNBZOQQRV-UHFFFAOYSA-N |