2-(6-methoxy-2-oxo-2H-1-benzopyran-3-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-(6-methoxy-2-oxo-2H-1-benzopyran-3-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
2-(6-methoxy-2-oxo-2H-1-benzopyran-3-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | 1711-1435 |
| Compound Name: | 2-(6-methoxy-2-oxo-2H-1-benzopyran-3-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 380.42 |
| Molecular Formula: | C20 H16 N2 O4 S |
| Smiles: | COc1ccc2c(C=C(C3NC(c4c5CCCCc5sc4N=3)=O)C(=O)O2)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.3228 |
| logD: | 2.6152 |
| logSw: | -3.9943 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.179 |
| InChI Key: | XLZCFVNBAQAJMU-UHFFFAOYSA-N |