TL;DR: F0561-0427 (CAS 1009712-18-8) is a chemical compound with molecular formula C18H13ClFN3O2S and molecular weight 389.0401 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[2-(3-chlorophenyl)-5-oxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-4-fluorobenzamide
Also Known As: F0561-0427, N-[2-(3-chlorophenyl)-5-oxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-4-fluorobenzamide, N-(2-(3-chlorophenyl)-5-oxido-4,6-dihydro-2H-thieno[3,4-c]pyrazol-3-yl)-4-fluorobenzamide
| Molecular Formula | C18H13ClFN3O2S |
| Molecular Weight | 389.0401 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 83.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 389.0401 Da |
| Heavy Atoms | 26 |
| Complexity | 561.0 |
| SMILES | C1C2=C(N(N=C2CS1=O)C3=CC(=CC=C3)Cl)NC(=O)C4=CC=C(C=C4)F |
| InChIKey | PRLFFKKEIABZPB-UHFFFAOYSA-N |
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F0561-0427. The TPSA of 83.2 Ų falls within the moderate polarity range, balancing permeability and solubility for F0561-0427. Following Lipinski's Rule of Five, F0561-0427 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 F0561-0427 is 1009712-18-8.
The molecular formula of F0561-0427 is C18H13ClFN3O2S.
The molecular weight of F0561-0427 is 389.0401 g/mol.
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