ethyl 4-{2-[2-(methylsulfanyl)-7-oxo[1,3]thiazolo[4,5-d]pyrimidin-6(7H)-yl]acetamido}benzoate
Chemical Structure Depiction of
ethyl 4-{2-[2-(methylsulfanyl)-7-oxo[1,3]thiazolo[4,5-d]pyrimidin-6(7H)-yl]acetamido}benzoate
ethyl 4-{2-[2-(methylsulfanyl)-7-oxo[1,3]thiazolo[4,5-d]pyrimidin-6(7H)-yl]acetamido}benzoate
Compound characteristics
| Compound ID: | F802-0016 |
| Compound Name: | ethyl 4-{2-[2-(methylsulfanyl)-7-oxo[1,3]thiazolo[4,5-d]pyrimidin-6(7H)-yl]acetamido}benzoate |
| Molecular Weight: | 404.46 |
| Molecular Formula: | C17 H16 N4 O4 S2 |
| Smiles: | CCOC(c1ccc(cc1)NC(CN1C=Nc2c(C1=O)sc(n2)SC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2045 |
| logD: | 3.2044 |
| logSw: | -3.3333 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.184 |
| InChI Key: | QWEZQBRVXNRNJX-UHFFFAOYSA-N |