3-(4-ethoxyphenyl)-2-sulfanylidene-5-({[4-(trifluoromethoxy)phenyl]methyl}sulfanyl)-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Chemical Structure Depiction of
3-(4-ethoxyphenyl)-2-sulfanylidene-5-({[4-(trifluoromethoxy)phenyl]methyl}sulfanyl)-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
3-(4-ethoxyphenyl)-2-sulfanylidene-5-({[4-(trifluoromethoxy)phenyl]methyl}sulfanyl)-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Compound characteristics
| Compound ID: | K286-3473 |
| Compound Name: | 3-(4-ethoxyphenyl)-2-sulfanylidene-5-({[4-(trifluoromethoxy)phenyl]methyl}sulfanyl)-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one |
| Molecular Weight: | 511.56 |
| Molecular Formula: | C21 H16 F3 N3 O3 S3 |
| Smiles: | CCOc1ccc(cc1)N1C2=C(C(NC(=N2)SCc2ccc(cc2)OC(F)(F)F)=O)SC1=S |
| Stereo: | ACHIRAL |
| logP: | 5.1706 |
| logD: | 5.1697 |
| logSw: | -4.9221 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.356 |
| InChI Key: | PSLVZCVKUPLZJR-UHFFFAOYSA-N |