methyl 4-{2-[(2H-1,3-benzodioxol-5-yl)amino]-2-oxoethoxy}-6-chloroquinoline-2-carboxylate
Chemical Structure Depiction of
methyl 4-{2-[(2H-1,3-benzodioxol-5-yl)amino]-2-oxoethoxy}-6-chloroquinoline-2-carboxylate
methyl 4-{2-[(2H-1,3-benzodioxol-5-yl)amino]-2-oxoethoxy}-6-chloroquinoline-2-carboxylate
Compound characteristics
| Compound ID: | L479-0407 |
| Compound Name: | methyl 4-{2-[(2H-1,3-benzodioxol-5-yl)amino]-2-oxoethoxy}-6-chloroquinoline-2-carboxylate |
| Molecular Weight: | 414.8 |
| Molecular Formula: | C20 H15 Cl N2 O6 |
| Smiles: | COC(c1cc(c2cc(ccc2n1)[Cl])OCC(Nc1ccc2c(c1)OCO2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9409 |
| logD: | 3.9408 |
| logSw: | -4.3489 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.322 |
| InChI Key: | CIVXARNMTMFAHM-UHFFFAOYSA-N |