5-[(2H-1,3-benzodioxol-5-yl)oxy]-2-(4-methylphenyl)-4-[3-(morpholine-4-carbonyl)anilino]pyridazin-3(2H)-one
Chemical Structure Depiction of
5-[(2H-1,3-benzodioxol-5-yl)oxy]-2-(4-methylphenyl)-4-[3-(morpholine-4-carbonyl)anilino]pyridazin-3(2H)-one
5-[(2H-1,3-benzodioxol-5-yl)oxy]-2-(4-methylphenyl)-4-[3-(morpholine-4-carbonyl)anilino]pyridazin-3(2H)-one
Compound characteristics
| Compound ID: | V002-2696 |
| Compound Name: | 5-[(2H-1,3-benzodioxol-5-yl)oxy]-2-(4-methylphenyl)-4-[3-(morpholine-4-carbonyl)anilino]pyridazin-3(2H)-one |
| Molecular Weight: | 526.55 |
| Molecular Formula: | C29 H26 N4 O6 |
| Smiles: | Cc1ccc(cc1)N1C(C(=C(C=N1)Oc1ccc2c(c1)OCO2)Nc1cccc(c1)C(N1CCOCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4832 |
| logD: | 3.4758 |
| logSw: | -3.703 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.989 |
| InChI Key: | HTOFFJAWYMEOAX-UHFFFAOYSA-N |