3-[3-(3,4-dihydroisoquinolin-2(1H)-yl)-3-oxopropyl]-1-[(2,4-dimethylphenyl)methyl]quinazoline-2,4(1H,3H)-dione
Chemical Structure Depiction of
3-[3-(3,4-dihydroisoquinolin-2(1H)-yl)-3-oxopropyl]-1-[(2,4-dimethylphenyl)methyl]quinazoline-2,4(1H,3H)-dione
3-[3-(3,4-dihydroisoquinolin-2(1H)-yl)-3-oxopropyl]-1-[(2,4-dimethylphenyl)methyl]quinazoline-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | C260-1591 |
| Compound Name: | 3-[3-(3,4-dihydroisoquinolin-2(1H)-yl)-3-oxopropyl]-1-[(2,4-dimethylphenyl)methyl]quinazoline-2,4(1H,3H)-dione |
| Molecular Weight: | 467.57 |
| Molecular Formula: | C29 H29 N3 O3 |
| Smiles: | Cc1ccc(CN2C(N(CCC(N3CCc4ccccc4C3)=O)C(c3ccccc23)=O)=O)c(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.8226 |
| logD: | 4.8226 |
| logSw: | -4.5288 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.3 |
| InChI Key: | YOOKTPCVCMZIRV-UHFFFAOYSA-N |