N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-{3-[4-(4-fluorophenyl)piperazin-1-yl]-6-oxopyridazin-1(6H)-yl}acetamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-{3-[4-(4-fluorophenyl)piperazin-1-yl]-6-oxopyridazin-1(6H)-yl}acetamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-{3-[4-(4-fluorophenyl)piperazin-1-yl]-6-oxopyridazin-1(6H)-yl}acetamide
Compound characteristics
| Compound ID: | F046-0431 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-{3-[4-(4-fluorophenyl)piperazin-1-yl]-6-oxopyridazin-1(6H)-yl}acetamide |
| Molecular Weight: | 465.48 |
| Molecular Formula: | C24 H24 F N5 O4 |
| Smiles: | C(c1ccc2c(c1)OCO2)NC(CN1C(C=CC(=N1)N1CCN(CC1)c1ccc(cc1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.42 |
| logD: | 2.42 |
| logSw: | -2.9814 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.971 |
| InChI Key: | LERQUGJGFWELRZ-UHFFFAOYSA-N |