6-(2-fluorophenyl)-3-(2-methylphenyl)-5-{[1-(morpholin-4-yl)-1-oxobutan-2-yl]sulfanyl}-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Chemical Structure Depiction of
6-(2-fluorophenyl)-3-(2-methylphenyl)-5-{[1-(morpholin-4-yl)-1-oxobutan-2-yl]sulfanyl}-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
6-(2-fluorophenyl)-3-(2-methylphenyl)-5-{[1-(morpholin-4-yl)-1-oxobutan-2-yl]sulfanyl}-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Compound characteristics
| Compound ID: | K286-3609 |
| Compound Name: | 6-(2-fluorophenyl)-3-(2-methylphenyl)-5-{[1-(morpholin-4-yl)-1-oxobutan-2-yl]sulfanyl}-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one |
| Molecular Weight: | 556.7 |
| Molecular Formula: | C26 H25 F N4 O3 S3 |
| Smiles: | CCC(C(N1CCOCC1)=O)SC1=NC2=C(C(N1c1ccccc1F)=O)SC(N2c1ccccc1C)=S |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5856 |
| logD: | 4.5856 |
| logSw: | -4.3062 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 51.181 |
| InChI Key: | AEDATJJVYGPEHZ-FQEVSTJZSA-N |