N-(2H-1,3-benzodioxol-5-yl)-2-{8-fluoro-5-[(3-methylphenyl)methyl]-3-oxo-3,5-dihydro-2H-pyrazolo[4,3-c]quinolin-2-yl}acetamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-2-{8-fluoro-5-[(3-methylphenyl)methyl]-3-oxo-3,5-dihydro-2H-pyrazolo[4,3-c]quinolin-2-yl}acetamide
N-(2H-1,3-benzodioxol-5-yl)-2-{8-fluoro-5-[(3-methylphenyl)methyl]-3-oxo-3,5-dihydro-2H-pyrazolo[4,3-c]quinolin-2-yl}acetamide
Compound characteristics
| Compound ID: | E844-1750 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-2-{8-fluoro-5-[(3-methylphenyl)methyl]-3-oxo-3,5-dihydro-2H-pyrazolo[4,3-c]quinolin-2-yl}acetamide |
| Molecular Weight: | 484.49 |
| Molecular Formula: | C27 H21 F N4 O4 |
| Smiles: | Cc1cccc(CN2C=C3C(c4cc(ccc24)F)=NN(CC(Nc2ccc4c(c2)OCO4)=O)C3=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.0304 |
| logD: | 4.0304 |
| logSw: | -4.2958 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.768 |
| InChI Key: | PXDZBFUMNKACGH-UHFFFAOYSA-N |