2-[7-benzyl-2-(4-methylphenyl)-4-oxo-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-3(4H)-yl]-N-[(thiophen-2-yl)methyl]acetamide
Chemical Structure Depiction of
2-[7-benzyl-2-(4-methylphenyl)-4-oxo-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-3(4H)-yl]-N-[(thiophen-2-yl)methyl]acetamide
2-[7-benzyl-2-(4-methylphenyl)-4-oxo-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-3(4H)-yl]-N-[(thiophen-2-yl)methyl]acetamide
Compound characteristics
Compound ID: | L392-0559 |
Compound Name: | 2-[7-benzyl-2-(4-methylphenyl)-4-oxo-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-3(4H)-yl]-N-[(thiophen-2-yl)methyl]acetamide |
Molecular Weight: | 484.62 |
Molecular Formula: | C28 H28 N4 O2 S |
Smiles: | Cc1ccc(cc1)C1=NC2CN(CCC=2C(N1CC(NCc1cccs1)=O)=O)Cc1ccccc1 |
Stereo: | ACHIRAL |
logP: | 3.9803 |
logD: | 3.0557 |
logSw: | -3.9762 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 54.284 |
InChI Key: | ZALPRSWYFOJJAW-UHFFFAOYSA-N |