ethyl [6,6-dimethyl-2,4-dioxo-1-{2-oxo-2-[(1,3-thiazol-2-yl)amino]ethyl}-1,5,6,8-tetrahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-3(4H)-yl]acetate
Chemical Structure Depiction of
ethyl [6,6-dimethyl-2,4-dioxo-1-{2-oxo-2-[(1,3-thiazol-2-yl)amino]ethyl}-1,5,6,8-tetrahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-3(4H)-yl]acetate
ethyl [6,6-dimethyl-2,4-dioxo-1-{2-oxo-2-[(1,3-thiazol-2-yl)amino]ethyl}-1,5,6,8-tetrahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-3(4H)-yl]acetate
Compound characteristics
| Compound ID: | 8640-0202 |
| Compound Name: | ethyl [6,6-dimethyl-2,4-dioxo-1-{2-oxo-2-[(1,3-thiazol-2-yl)amino]ethyl}-1,5,6,8-tetrahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-3(4H)-yl]acetate |
| Molecular Weight: | 478.54 |
| Molecular Formula: | C20 H22 N4 O6 S2 |
| Smiles: | [H]N(C(CN1C(N(CC(=O)OCC)C(c2c3CC(C)(C)OCc3sc12)=O)=O)=O)c1nccs1 |
| Stereo: | ACHIRAL |
| logP: | 2.6038 |
| logD: | 2.6035 |
| logSw: | -2.7928 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 93.394 |
| InChI Key: | GDDYRFSNXCRDTB-UHFFFAOYSA-N |