N-(4-chlorophenyl)-2-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-4-methyl-6-oxopyrimidin-1(6H)-yl]acetamide
Chemical Structure Depiction of
N-(4-chlorophenyl)-2-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-4-methyl-6-oxopyrimidin-1(6H)-yl]acetamide
N-(4-chlorophenyl)-2-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-4-methyl-6-oxopyrimidin-1(6H)-yl]acetamide
Compound characteristics
Compound ID: | P194-1281 |
Compound Name: | N-(4-chlorophenyl)-2-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-4-methyl-6-oxopyrimidin-1(6H)-yl]acetamide |
Molecular Weight: | 408.89 |
Molecular Formula: | C22 H21 Cl N4 O2 |
Smiles: | CC1=CC(N(CC(Nc2ccc(cc2)[Cl])=O)C(=N1)N1CCc2ccccc2C1)=O |
Stereo: | ACHIRAL |
logP: | 3.5991 |
logD: | 3.599 |
logSw: | -3.9153 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 51.767 |
InChI Key: | QQPVNNXEHGPNNU-UHFFFAOYSA-N |