TL;DR: AB00668456-01 (CAS 1009235-33-9) is a chemical compound with molecular formula C19H16FN3O3S and molecular weight 385.08963 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-fluoro-N-[2-(4-methoxyphenyl)-5-oxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]benzamide
Also Known As: AB00668456-01, F0561-0429, 4-fluoro-N-[2-(4-methoxyphenyl)-5-oxo-2H,4H,6H-5lambda4-thieno[3,4-c]pyrazol-3-yl]benzamide, 4-fluoro-N-(2-(4-methoxyphenyl)-5-oxido-4,6-dihydro-2H-thieno[3,4-c]pyrazol-3-yl)benzamide, 4-fluoro-N-[2-(4-methoxyphenyl)-5-oxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]benzamide
| Molecular Formula | C19H16FN3O3S |
| Molecular Weight | 385.08963 g/mol |
| XLogP | 1.9 |
| Topological Polar Surface Area (TPSA) | 92.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 385.08963 Da |
| Heavy Atoms | 27 |
| Complexity | 564.0 |
| SMILES | COC1=CC=C(C=C1)N2C(=C3CS(=O)CC3=N2)NC(=O)C4=CC=C(C=C4)F |
| InChIKey | FAMDCWJJYORLRG-UHFFFAOYSA-N |
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00668456-01. The TPSA of 92.4 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00668456-01. Following Lipinski's Rule of Five, AB00668456-01 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 AB00668456-01 is 1009235-33-9.
The molecular formula of AB00668456-01 is C19H16FN3O3S.
The molecular weight of AB00668456-01 is 385.08963 g/mol.
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