N-[2-{2-[(2H-1,3-benzodioxol-5-yl)amino]-2-oxoethyl}-6-(4-methylphenyl)-3-oxo-2,3-dihydropyridazin-4-yl]benzamide
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]benzamide
N-[2-{2-[(2H-1,3-benzodioxol-5-yl)amino]-2-oxoethyl}-6-(4-methylphenyl)-3-oxo-2,3-dihydropyridazin-4-yl]benzamide
Compound characteristics
| Compound ID: | J046-0855 |
| Compound Name: | N-[2-{2-[(2H-1,3-benzodioxol-5-yl)amino]-2-oxoethyl}-6-(4-methylphenyl)-3-oxo-2,3-dihydropyridazin-4-yl]benzamide |
| Molecular Weight: | 482.5 |
| Molecular Formula: | C27 H22 N4 O5 |
| Smiles: | Cc1ccc(cc1)C1C=C(C(N(CC(Nc2ccc3c(c2)OCO3)=O)N=1)=O)NC(c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1509 |
| logD: | 3.8827 |
| logSw: | -4.2767 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 92.589 |
| InChI Key: | MHEBRJGGDQNENL-UHFFFAOYSA-N |