1-{3-[(2H-1,3-benzodioxol-5-yl)amino]-3-oxopropyl}-N-(4-methylphenyl)-6-oxo-1,6-dihydropyridazine-3-carboxamide
Chemical Structure Depiction of
1-{3-[(2H-1,3-benzodioxol-5-yl)amino]-3-oxopropyl}-N-(4-methylphenyl)-6-oxo-1,6-dihydropyridazine-3-carboxamide
1-{3-[(2H-1,3-benzodioxol-5-yl)amino]-3-oxopropyl}-N-(4-methylphenyl)-6-oxo-1,6-dihydropyridazine-3-carboxamide
Compound characteristics
| Compound ID: | F550-2476 |
| Compound Name: | 1-{3-[(2H-1,3-benzodioxol-5-yl)amino]-3-oxopropyl}-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(CCC(Nc2ccc3c(c2)OCO3)=O)N=1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6632 |
| logD: | 2.6474 |
| logSw: | -3.1729 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 92.154 |
| InChI Key: | XKUYKIBHEAUMPT-UHFFFAOYSA-N |