2-[4-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-2-oxoquinolin-1(2H)-yl]-N-(2,5-dimethoxyphenyl)acetamide
Chemical Structure Depiction of
2-[4-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-2-oxoquinolin-1(2H)-yl]-N-(2,5-dimethoxyphenyl)acetamide
2-[4-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-2-oxoquinolin-1(2H)-yl]-N-(2,5-dimethoxyphenyl)acetamide
Compound characteristics
| Compound ID: | J078-0874 |
| Compound Name: | 2-[4-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-2-oxoquinolin-1(2H)-yl]-N-(2,5-dimethoxyphenyl)acetamide |
| Molecular Weight: | 497.55 |
| Molecular Formula: | C29 H27 N3 O5 |
| Smiles: | COc1ccc(c(c1)NC(CN1C(C=C(C(N2CCc3ccccc3C2)=O)c2ccccc12)=O)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 3.2248 |
| logD: | 3.2244 |
| logSw: | -3.7136 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.555 |
| InChI Key: | XOTRRLNXJZCCBC-UHFFFAOYSA-N |