N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[6-oxo-3-(4-phenylpiperazin-1-yl)pyridazin-1(6H)-yl]acetamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[6-oxo-3-(4-phenylpiperazin-1-yl)pyridazin-1(6H)-yl]acetamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[6-oxo-3-(4-phenylpiperazin-1-yl)pyridazin-1(6H)-yl]acetamide
Compound characteristics
| Compound ID: | F046-0155 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[6-oxo-3-(4-phenylpiperazin-1-yl)pyridazin-1(6H)-yl]acetamide |
| Molecular Weight: | 447.49 |
| Molecular Formula: | C24 H25 N5 O4 |
| Smiles: | C(c1ccc2c(c1)OCO2)NC(CN1C(C=CC(=N1)N1CCN(CC1)c1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2693 |
| logD: | 2.2692 |
| logSw: | -2.9401 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.971 |
| InChI Key: | VALRDOKRWQCLRI-UHFFFAOYSA-N |