3-(2-fluoro-5-methylphenyl)-5-{[(2-fluorophenyl)methyl]sulfanyl}-6-(4-methylphenyl)-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Chemical Structure Depiction of
3-(2-fluoro-5-methylphenyl)-5-{[(2-fluorophenyl)methyl]sulfanyl}-6-(4-methylphenyl)-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
3-(2-fluoro-5-methylphenyl)-5-{[(2-fluorophenyl)methyl]sulfanyl}-6-(4-methylphenyl)-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Compound characteristics
Compound ID: | K286-3897 |
Compound Name: | 3-(2-fluoro-5-methylphenyl)-5-{[(2-fluorophenyl)methyl]sulfanyl}-6-(4-methylphenyl)-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one |
Molecular Weight: | 523.64 |
Molecular Formula: | C26 H19 F2 N3 O S3 |
Smiles: | Cc1ccc(cc1)N1C(=NC2=C(C1=O)SC(N2c1cc(C)ccc1F)=S)SCc1ccccc1F |
Stereo: | ACHIRAL |
logP: | 6.8885 |
logD: | 6.8885 |
logSw: | -5.6545 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 26.6536 |
InChI Key: | NTBXAQWPDWRIDW-UHFFFAOYSA-N |