N-(2-methoxyphenyl)-4-[2-(4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)acetamido]butanamide
Chemical Structure Depiction of
N-(2-methoxyphenyl)-4-[2-(4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)acetamido]butanamide
N-(2-methoxyphenyl)-4-[2-(4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)acetamido]butanamide
Compound characteristics
Compound ID: | C046-0147 |
Compound Name: | N-(2-methoxyphenyl)-4-[2-(4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)acetamido]butanamide |
Molecular Weight: | 454.55 |
Molecular Formula: | C23 H26 N4 O4 S |
Smiles: | COc1ccccc1NC(CCCNC(CN1C=Nc2c(C1=O)c1CCCCc1s2)=O)=O |
Stereo: | ACHIRAL |
logP: | 1.725 |
logD: | 1.7249 |
logSw: | -2.3785 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 80.557 |
InChI Key: | ROIWPAHDHARGHD-UHFFFAOYSA-N |