7-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-1,3-dimethyl-1H-pyrrolo[2,3-d]pyrimidine-2,4(3H,7H)-dione
Chemical Structure Depiction of
7-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-1,3-dimethyl-1H-pyrrolo[2,3-d]pyrimidine-2,4(3H,7H)-dione
7-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-1,3-dimethyl-1H-pyrrolo[2,3-d]pyrimidine-2,4(3H,7H)-dione
Compound characteristics
| Compound ID: | L462-0436 |
| Compound Name: | 7-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-1,3-dimethyl-1H-pyrrolo[2,3-d]pyrimidine-2,4(3H,7H)-dione |
| Molecular Weight: | 352.39 |
| Molecular Formula: | C19 H20 N4 O3 |
| Smiles: | CN1C(c2ccn(CC(N3CCc4ccccc4C3)=O)c2N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8595 |
| logD: | 1.8595 |
| logSw: | -2.4455 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 49.738 |
| InChI Key: | OARFKOQGYDPUJK-UHFFFAOYSA-N |