5-[(2H-1,3-benzodioxol-5-yl)oxy]-2-(4-methylphenyl)-4-[3-(pyrrolidine-1-carbonyl)anilino]pyridazin-3(2H)-one
Chemical Structure Depiction of
5-[(2H-1,3-benzodioxol-5-yl)oxy]-2-(4-methylphenyl)-4-[3-(pyrrolidine-1-carbonyl)anilino]pyridazin-3(2H)-one
5-[(2H-1,3-benzodioxol-5-yl)oxy]-2-(4-methylphenyl)-4-[3-(pyrrolidine-1-carbonyl)anilino]pyridazin-3(2H)-one
Compound characteristics
| Compound ID: | V023-1063 |
| Compound Name: | 5-[(2H-1,3-benzodioxol-5-yl)oxy]-2-(4-methylphenyl)-4-[3-(pyrrolidine-1-carbonyl)anilino]pyridazin-3(2H)-one |
| Molecular Weight: | 510.55 |
| Molecular Formula: | C29 H26 N4 O5 |
| Smiles: | Cc1ccc(cc1)N1C(C(=C(C=N1)Oc1ccc2c(c1)OCO2)Nc1cccc(c1)C(N1CCCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3546 |
| logD: | 4.3472 |
| logSw: | -4.3465 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.446 |
| InChI Key: | VTPSLKRKVMMFHH-UHFFFAOYSA-N |