methyl 4-[(2H-1,3-benzodioxol-5-yl)amino]quinoline-2-carboxylate
Chemical Structure Depiction of
methyl 4-[(2H-1,3-benzodioxol-5-yl)amino]quinoline-2-carboxylate
methyl 4-[(2H-1,3-benzodioxol-5-yl)amino]quinoline-2-carboxylate
Compound characteristics
| Compound ID: | L480-0025 |
| Compound Name: | methyl 4-[(2H-1,3-benzodioxol-5-yl)amino]quinoline-2-carboxylate |
| Molecular Weight: | 322.32 |
| Molecular Formula: | C18 H14 N2 O4 |
| Smiles: | COC(c1cc(c2ccccc2n1)Nc1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0592 |
| logD: | 4.0592 |
| logSw: | -4.2387 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.073 |
| InChI Key: | PHGGFVSFYFZCBX-UHFFFAOYSA-N |