N-(2-{2-[(2H-1,3-benzodioxol-5-yl)amino]-2-oxoethyl}-3-oxo-6-phenyl-2,3-dihydropyridazin-4-yl)propanamide
Chemical Structure Depiction of
N-(2-{2-[(2H-1,3-benzodioxol-5-yl)amino]-2-oxoethyl}-3-oxo-6-phenyl-2,3-dihydropyridazin-4-yl)propanamide
N-(2-{2-[(2H-1,3-benzodioxol-5-yl)amino]-2-oxoethyl}-3-oxo-6-phenyl-2,3-dihydropyridazin-4-yl)propanamide
Compound characteristics
| Compound ID: | J046-0401 |
| Compound Name: | N-(2-{2-[(2H-1,3-benzodioxol-5-yl)amino]-2-oxoethyl}-3-oxo-6-phenyl-2,3-dihydropyridazin-4-yl)propanamide |
| Molecular Weight: | 420.42 |
| Molecular Formula: | C22 H20 N4 O5 |
| Smiles: | CCC(NC1=CC(c2ccccc2)=NN(CC(Nc2ccc3c(c2)OCO3)=O)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.662 |
| logD: | 2.6504 |
| logSw: | -3.1287 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 92.647 |
| InChI Key: | RUJKBMNZRGQGKW-UHFFFAOYSA-N |