TL;DR: F0561-0745 (CAS 1019103-10-6) is a chemical compound with molecular formula C25H28N4O4S2 and molecular weight 512.1552 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[2-(2,3-dimethylphenyl)-5-oxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-4-piperidin-1-ylsulfonylbenzamide
Also Known As: F0561-0745, N-[2-(2,3-dimethylphenyl)-5-oxo-2H,4H,6H-5lambda4-thieno[3,4-c]pyrazol-3-yl]-4-(piperidine-1-sulfonyl)benzamide, N-[2-(2,3-dimethylphenyl)-5-oxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-4-piperidin-1-ylsulfonylbenzamide, N-(2-(2,3-dimethylphenyl)-5-oxido-4,6-dihydro-2H-thieno[3,4-c]pyrazol-3-yl)-4-(piperidin-1-ylsulfonyl)benzamide
| Molecular Formula | C25H28N4O4S2 |
| Molecular Weight | 512.1552 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 129.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 512.1552 Da |
| Heavy Atoms | 35 |
| Complexity | 896.0 |
| SMILES | CC1=C(C(=CC=C1)N2C(=C3CS(=O)CC3=N2)NC(=O)C4=CC=C(C=C4)S(=O)(=O)N5CCCCC5)C |
| InChIKey | TYCMJBIGACRHFD-UHFFFAOYSA-N |
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F0561-0745. The TPSA of 129.0 Ų falls within the moderate polarity range, balancing permeability and solubility for F0561-0745. Following Lipinski's Rule of Five, F0561-0745 has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of F0561-0745 is 1019103-10-6.
The molecular formula of F0561-0745 is C25H28N4O4S2.
The molecular weight of F0561-0745 is 512.1552 g/mol.
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