TL;DR: F0561-0567 (CAS 1009515-57-4) is a chemical compound with molecular formula C19H15F2N3O2S and molecular weight 387.0853 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,6-difluoro-N-[2-(2-methylphenyl)-5-oxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]benzamide
Also Known As: F0561-0567, 2,6-difluoro-N-(5-oxido-2-(o-tolyl)-4,6-dihydro-2H-thieno[3,4-c]pyrazol-3-yl)benzamide, 2,6-difluoro-N-[2-(2-methylphenyl)-5-oxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]benzamide, 2,6-difluoro-N-[2-(2-methylphenyl)-5-oxo-2H,4H,6H-5lambda4-thieno[3,4-c]pyrazol-3-yl]benzamide, 4-(2,6-difluorobenzylamino)-3-(o-tolyl)-7-thia-2,3-diazabicyclo[3.3.0]octa-1,4-dien-7-ium-7-olate
| Molecular Formula | C19H15F2N3O2S |
| Molecular Weight | 387.0853 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 83.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 387.0853 Da |
| Heavy Atoms | 27 |
| Complexity | 585.0 |
| SMILES | CC1=CC=CC=C1N2C(=C3CS(=O)CC3=N2)NC(=O)C4=C(C=CC=C4F)F |
| InChIKey | CCLPEKUZRWAZPP-UHFFFAOYSA-N |
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F0561-0567. The TPSA of 83.2 Ų falls within the moderate polarity range, balancing permeability and solubility for F0561-0567. Following Lipinski's Rule of Five, F0561-0567 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 F0561-0567 is 1009515-57-4.
The molecular formula of F0561-0567 is C19H15F2N3O2S.
The molecular weight of F0561-0567 is 387.0853 g/mol.
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