TL;DR: 4-methoxy-1-(4-methylphenyl)-N-[2-(methylsulfanyl)phenyl]-6-oxo-1,6-dihydropyridazine-3-carboxamide (CAS 1004391-61-0) is a chemical compound with molecular formula C20H19N3O3S and molecular weight 381.11472 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-methoxy-1-(4-methylphenyl)-N-(2-methylsulfanylphenyl)-6-oxopyridazine-3-carboxamide
Also Known As: 4-methoxy-1-(4-methylphenyl)-N-[2-(methylsulfanyl)phenyl]-6-oxo-1,6-dihydropyridazine-3-carboxamide, F2213-0527, 4-methoxy-1-(4-methylphenyl)-N-(2-methylsulfanylphenyl)-6-oxopyridazine-3-carboxamide, 4-methoxy-N-(2-(methylthio)phenyl)-6-oxo-1-(p-tolyl)-1,6-dihydropyridazine-3-carboxamide, 4-methoxy-1-(4-methylphenyl)-N-[2-(methylthio)phenyl]-6-oxo-1,6-dihydropyridazine-3-carboxamide
| Molecular Formula | C20H19N3O3S |
| Molecular Weight | 381.11472 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 96.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 381.11472 Da |
| Heavy Atoms | 27 |
| Complexity | 626.0 |
| SMILES | CC1=CC=C(C=C1)N2C(=O)C=C(C(=N2)C(=O)NC3=CC=CC=C3SC)OC |
| InChIKey | DIERLPWYVXRIJS-UHFFFAOYSA-N |
The XLogP value of 3.3 indicates that 4-methoxy-1-(4-methylphenyl)-N-[2-(methylsulfanyl)phenyl]-6-oxo-1,6-dihydropyridazine-3-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-methoxy-1-(4-methylphenyl)-N-[2-(methylsulfanyl)phenyl]-6-oxo-1,6-dihydropyridazine-3-carboxamide. Following Lipinski's Rule of Five, 4-methoxy-1-(4-methylphenyl)-N-[2-(methylsulfanyl)phenyl]-6-oxo-1,6-dihydropyridazine-3-carboxamide has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 4-methoxy-1-(4-methylphenyl)-N-[2-(methylsulfanyl)phenyl]-6-oxo-1,6-dihydropyridazine-3-carboxamide is 1004391-61-0.
The molecular formula of 4-methoxy-1-(4-methylphenyl)-N-[2-(methylsulfanyl)phenyl]-6-oxo-1,6-dihydropyridazine-3-carboxamide is C20H19N3O3S.
The molecular weight of 4-methoxy-1-(4-methylphenyl)-N-[2-(methylsulfanyl)phenyl]-6-oxo-1,6-dihydropyridazine-3-carboxamide is 381.11472 g/mol.
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