ethyl 5-[3-{[(3,4-dichlorophenyl)methyl]amino}-1-(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-3-oxopropyl]-4-hydroxy-6-oxo-1,6-dihydropyridine-3-carboxylate
Chemical Structure Depiction of
ethyl 5-[3-{[(3,4-dichlorophenyl)methyl]amino}-1-(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-3-oxopropyl]-4-hydroxy-6-oxo-1,6-dihydropyridine-3-carboxylate
ethyl 5-[3-{[(3,4-dichlorophenyl)methyl]amino}-1-(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-3-oxopropyl]-4-hydroxy-6-oxo-1,6-dihydropyridine-3-carboxylate
Compound characteristics
| Compound ID: | 8020-8520 |
| Compound Name: | ethyl 5-[3-{[(3,4-dichlorophenyl)methyl]amino}-1-(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-3-oxopropyl]-4-hydroxy-6-oxo-1,6-dihydropyridine-3-carboxylate |
| Molecular Weight: | 593.42 |
| Molecular Formula: | C27 H26 Cl2 N2 O9 |
| Smiles: | CCOC(C1=CNC(C(C(CC(NCc2ccc(c(c2)[Cl])[Cl])=O)c2cc(c3c(c2OC)OCO3)OC)=C1O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1067 |
| logD: | 0.4288 |
| logSw: | -3.1393 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 116.59 |
| InChI Key: | FKOHXOJKMWWBBP-AWEZNQCLSA-N |