2-(5-acetamido-6-oxo-3-phenylpyridazin-1(6H)-yl)-N-(2H-1,3-benzodioxol-5-yl)acetamide
Chemical Structure Depiction of
2-(5-acetamido-6-oxo-3-phenylpyridazin-1(6H)-yl)-N-(2H-1,3-benzodioxol-5-yl)acetamide
2-(5-acetamido-6-oxo-3-phenylpyridazin-1(6H)-yl)-N-(2H-1,3-benzodioxol-5-yl)acetamide
Compound characteristics
| Compound ID: | J046-0020 |
| Compound Name: | 2-(5-acetamido-6-oxo-3-phenylpyridazin-1(6H)-yl)-N-(2H-1,3-benzodioxol-5-yl)acetamide |
| Molecular Weight: | 406.4 |
| Molecular Formula: | C21 H18 N4 O5 |
| Smiles: | CC(NC1=CC(c2ccccc2)=NN(CC(Nc2ccc3c(c2)OCO3)=O)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1639 |
| logD: | 2.1573 |
| logSw: | -2.9856 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 92.76 |
| InChI Key: | QZDUJBMEICKCAK-UHFFFAOYSA-N |