2-[2-(3-methoxyphenyl)-4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl]-N-(3-methylphenyl)acetamide
Chemical Structure Depiction of
2-[2-(3-methoxyphenyl)-4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl]-N-(3-methylphenyl)acetamide
2-[2-(3-methoxyphenyl)-4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl]-N-(3-methylphenyl)acetamide
Compound characteristics
Compound ID: | K698-0452 |
Compound Name: | 2-[2-(3-methoxyphenyl)-4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl]-N-(3-methylphenyl)acetamide |
Molecular Weight: | 459.57 |
Molecular Formula: | C26 H25 N3 O3 S |
Smiles: | Cc1cccc(c1)NC(CN1C(c2cccc(c2)OC)=Nc2c(C1=O)c1CCCCc1s2)=O |
Stereo: | ACHIRAL |
logP: | 5.355 |
logD: | 5.355 |
logSw: | -5.2765 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 55.866 |
InChI Key: | YALKUTFZHPNMMA-UHFFFAOYSA-N |