N-(4-iodophenyl)-2-(4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)acetamide
Chemical Structure Depiction of
N-(4-iodophenyl)-2-(4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)acetamide
N-(4-iodophenyl)-2-(4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)acetamide
Compound characteristics
| Compound ID: | K667-0114 |
| Compound Name: | N-(4-iodophenyl)-2-(4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)acetamide |
| Molecular Weight: | 465.31 |
| Molecular Formula: | C18 H16 I N3 O2 S |
| Smiles: | C1CCc2c(C1)c1C(N(CC(Nc3ccc(cc3)I)=O)C=Nc1s2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3031 |
| logD: | 4.303 |
| logSw: | -4.4585 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.311 |
| InChI Key: | UDBRCPJBJIGYPB-UHFFFAOYSA-N |