4-[(2H-1,3-benzodioxol-5-yl)methyl]-6-phenylpyridazin-3(2H)-one
Chemical Structure Depiction of
4-[(2H-1,3-benzodioxol-5-yl)methyl]-6-phenylpyridazin-3(2H)-one
4-[(2H-1,3-benzodioxol-5-yl)methyl]-6-phenylpyridazin-3(2H)-one
Compound characteristics
| Compound ID: | Y041-6933 |
| Compound Name: | 4-[(2H-1,3-benzodioxol-5-yl)methyl]-6-phenylpyridazin-3(2H)-one |
| Molecular Weight: | 306.32 |
| Molecular Formula: | C18 H14 N2 O3 |
| Smiles: | C(C1=CC(c2ccccc2)=NNC1=O)c1ccc2c(c1)OCO2 |
| Stereo: | ACHIRAL |
| logP: | 3.6089 |
| logD: | 3.6089 |
| logSw: | -3.7492 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.276 |
| InChI Key: | KENGIXNKNALLGG-UHFFFAOYSA-N |