N-[2-{2-[(2H-1,3-benzodioxol-5-yl)amino]-2-oxoethyl}-6-(4-methylphenyl)-3-oxo-2,3-dihydropyridazin-4-yl]propanamide
Chemical Structure Depiction of
N-[2-{2-[(2H-1,3-benzodioxol-5-yl)amino]-2-oxoethyl}-6-(4-methylphenyl)-3-oxo-2,3-dihydropyridazin-4-yl]propanamide
N-[2-{2-[(2H-1,3-benzodioxol-5-yl)amino]-2-oxoethyl}-6-(4-methylphenyl)-3-oxo-2,3-dihydropyridazin-4-yl]propanamide
Compound characteristics
| Compound ID: | J046-0497 |
| Compound Name: | N-[2-{2-[(2H-1,3-benzodioxol-5-yl)amino]-2-oxoethyl}-6-(4-methylphenyl)-3-oxo-2,3-dihydropyridazin-4-yl]propanamide |
| Molecular Weight: | 434.45 |
| Molecular Formula: | C23 H22 N4 O5 |
| Smiles: | CCC(NC1=CC(c2ccc(C)cc2)=NN(CC(Nc2ccc3c(c2)OCO3)=O)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1904 |
| logD: | 3.1789 |
| logSw: | -3.2381 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 92.647 |
| InChI Key: | MXGHLHLCFSZRAE-UHFFFAOYSA-N |