7-(4-chlorophenyl)-3-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-1-ethylpyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
7-(4-chlorophenyl)-3-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-1-ethylpyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
7-(4-chlorophenyl)-3-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-1-ethylpyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | L558-0424 |
| Compound Name: | 7-(4-chlorophenyl)-3-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-1-ethylpyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 475.93 |
| Molecular Formula: | C25 H22 Cl N5 O3 |
| Smiles: | CCN1C(N(CC(N2CCc3ccccc3C2)=O)C(c2cnc(c3ccc(cc3)[Cl])nc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2326 |
| logD: | 4.2326 |
| logSw: | -4.5423 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 67.422 |
| InChI Key: | NJOXRYBORVCKGJ-UHFFFAOYSA-N |