1-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethyl)-N-(4-methylphenyl)-6-oxo-1,6-dihydropyridazine-3-carboxamide
Chemical Structure Depiction of
1-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethyl)-N-(4-methylphenyl)-6-oxo-1,6-dihydropyridazine-3-carboxamide
1-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethyl)-N-(4-methylphenyl)-6-oxo-1,6-dihydropyridazine-3-carboxamide
Compound characteristics
| Compound ID: | G871-0173 |
| Compound Name: | 1-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethyl)-N-(4-methylphenyl)-6-oxo-1,6-dihydropyridazine-3-carboxamide |
| Molecular Weight: | 420.42 |
| Molecular Formula: | C22 H20 N4 O5 |
| Smiles: | Cc1ccc(cc1)NC(C1C=CC(N(CC(NCc2ccc3c(c2)OCO3)=O)N=1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3498 |
| logD: | 2.341 |
| logSw: | -3.0059 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.497 |
| InChI Key: | LUFCFOCELPKLQI-UHFFFAOYSA-N |