2-(4-chlorophenyl)-6-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-4-methyl-1,2,4-triazine-3,5(2H,4H)-dione
Chemical Structure Depiction of
2-(4-chlorophenyl)-6-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-4-methyl-1,2,4-triazine-3,5(2H,4H)-dione
2-(4-chlorophenyl)-6-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-4-methyl-1,2,4-triazine-3,5(2H,4H)-dione
Compound characteristics
Compound ID: | G674-0593 |
Compound Name: | 2-(4-chlorophenyl)-6-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-4-methyl-1,2,4-triazine-3,5(2H,4H)-dione |
Molecular Weight: | 396.83 |
Molecular Formula: | C20 H17 Cl N4 O3 |
Smiles: | CN1C(C(C(N2CCc3ccccc3C2)=O)=NN(C1=O)c1ccc(cc1)[Cl])=O |
Stereo: | ACHIRAL |
logP: | 3.2096 |
logD: | 3.2096 |
logSw: | -3.4836 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 58.592 |
InChI Key: | OUYIKCLFKIQNJW-UHFFFAOYSA-N |