methyl 4-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethoxy)-6-methoxyquinoline-2-carboxylate
Chemical Structure Depiction of
methyl 4-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethoxy)-6-methoxyquinoline-2-carboxylate
methyl 4-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethoxy)-6-methoxyquinoline-2-carboxylate
Compound characteristics
| Compound ID: | L479-0235 |
| Compound Name: | methyl 4-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethoxy)-6-methoxyquinoline-2-carboxylate |
| Molecular Weight: | 424.41 |
| Molecular Formula: | C22 H20 N2 O7 |
| Smiles: | COC(c1cc(c2cc(ccc2n1)OC)OCC(NCc1ccc2c(c1)OCO2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8923 |
| logD: | 2.8923 |
| logSw: | -3.2809 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.188 |
| InChI Key: | QREQGOBNMLGFAK-UHFFFAOYSA-N |