TL;DR: N-(3-acetylphenyl)-2-(3-(3,4-dimethoxyphenyl)-6-oxopyridazin-1(6H)-yl)acetamide (CAS 1171732-97-0) is a chemical compound with molecular formula C22H21N3O5 and molecular weight 407.14813 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(3-acetylphenyl)-2-[3-(3,4-dimethoxyphenyl)-6-oxopyridazin-1-yl]acetamide
Also Known As: N-(3-acetylphenyl)-2-(3-(3,4-dimethoxyphenyl)-6-oxopyridazin-1(6H)-yl)acetamide, F2774-0486, N-(3-ACETYLPHENYL)-2-[3-(3,4-DIMETHOXYPHENYL)-6-OXO-1(6H)-PYRIDAZINYL]ACETAMIDE, N-(3-acetylphenyl)-2-[3-(3,4-dimethoxyphenyl)-6-oxopyridazin-1(6H)-yl]acetamide, N-(3-acetylphenyl)-2-[3-(3,4-dimethoxyphenyl)-6-oxopyridazin-1-yl]acetamide
| Molecular Formula | C22H21N3O5 |
| Molecular Weight | 407.14813 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 97.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 407.14813 Da |
| Heavy Atoms | 30 |
| Complexity | 720.0 |
| SMILES | CC(=O)C1=CC(=CC=C1)NC(=O)CN2C(=O)C=CC(=N2)C3=CC(=C(C=C3)OC)OC |
| InChIKey | JEXHTGIBYVNKBW-UHFFFAOYSA-N |
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3-acetylphenyl)-2-(3-(3,4-dimethoxyphenyl)-6-oxopyridazin-1(6H)-yl)acetamide. The TPSA of 97.3 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3-acetylphenyl)-2-(3-(3,4-dimethoxyphenyl)-6-oxopyridazin-1(6H)-yl)acetamide. Following Lipinski's Rule of Five, N-(3-acetylphenyl)-2-(3-(3,4-dimethoxyphenyl)-6-oxopyridazin-1(6H)-yl)acetamide has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of N-(3-acetylphenyl)-2-(3-(3,4-dimethoxyphenyl)-6-oxopyridazin-1(6H)-yl)acetamide is 1171732-97-0.
The molecular formula of N-(3-acetylphenyl)-2-(3-(3,4-dimethoxyphenyl)-6-oxopyridazin-1(6H)-yl)acetamide is C22H21N3O5.
The molecular weight of N-(3-acetylphenyl)-2-(3-(3,4-dimethoxyphenyl)-6-oxopyridazin-1(6H)-yl)acetamide is 407.14813 g/mol.
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