6-(2-methoxyphenyl)-5-(methylsulfanyl)-2-sulfanylidene-3-[3-(trifluoromethyl)phenyl]-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Chemical Structure Depiction of
6-(2-methoxyphenyl)-5-(methylsulfanyl)-2-sulfanylidene-3-[3-(trifluoromethyl)phenyl]-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
6-(2-methoxyphenyl)-5-(methylsulfanyl)-2-sulfanylidene-3-[3-(trifluoromethyl)phenyl]-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Compound characteristics
| Compound ID: | K286-0230 |
| Compound Name: | 6-(2-methoxyphenyl)-5-(methylsulfanyl)-2-sulfanylidene-3-[3-(trifluoromethyl)phenyl]-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one |
| Molecular Weight: | 481.54 |
| Molecular Formula: | C20 H14 F3 N3 O2 S3 |
| Smiles: | COc1ccccc1N1C(=NC2=C(C1=O)SC(N2c1cccc(c1)C(F)(F)F)=S)SC |
| Stereo: | ACHIRAL |
| logP: | 4.698 |
| logD: | 4.698 |
| logSw: | -4.5789 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 34.556 |
| InChI Key: | AHQHIPAUGNHVOG-UHFFFAOYSA-N |