TL;DR: F0561-0712 (CAS 1019102-76-1) is a chemical compound with molecular formula C20H28N4O4S2 and molecular weight 452.1552 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(2-tert-butyl-5-oxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)-4-(diethylsulfamoyl)benzamide
Also Known As: F0561-0712, N-(2-tert-butyl-5-oxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)-4-(diethylsulfamoyl)benzamide, N-{2-tert-butyl-5-oxo-2H,4H,6H-5lambda4-thieno[3,4-c]pyrazol-3-yl}-4-(diethylsulfamoyl)benzamide, N-(2-(tert-butyl)-5-oxido-4,6-dihydro-2H-thieno[3,4-c]pyrazol-3-yl)-4-(N,N-diethylsulfamoyl)benzamide
| Molecular Formula | C20H28N4O4S2 |
| Molecular Weight | 452.1552 g/mol |
| XLogP | 0.9 |
| Topological Polar Surface Area (TPSA) | 129.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 452.1552 Da |
| Heavy Atoms | 30 |
| Complexity | 750.0 |
| SMILES | CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C(=O)NC2=C3CS(=O)CC3=NN2C(C)(C)C |
| InChIKey | VJCOSZRVZKZHGV-UHFFFAOYSA-N |
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F0561-0712. The TPSA of 129.0 Ų falls within the moderate polarity range, balancing permeability and solubility for F0561-0712. Following Lipinski's Rule of Five, F0561-0712 has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of F0561-0712 is 1019102-76-1.
The molecular formula of F0561-0712 is C20H28N4O4S2.
The molecular weight of F0561-0712 is 452.1552 g/mol.
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