TL;DR: RefChem:229862 (CAS 150008-26-7) is a chemical compound with molecular formula C19H20FN3O5 and molecular weight 389.1387 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-cyclopropyl-6-fluoro-7-(4-hydroxyiminopiperidin-1-yl)-8-methoxy-4-oxoquinoline-3-carboxylic acid
Also Known As: s31076, S 31076, S-31076, 1-Cyclopropyl-6-fluoro-1,4-dihydro-7-[4-(hydroxyimino)-1-piperidinyl]-8-methoxy-4-oxo-3-quinolinecarboxylic acid, 3-Quinolinecarboxylic acid, 1-cyclopropyl-6-fluoro-1,4-dihydro-7-[4-(hydroxyimino)-1-piperidinyl]-8-methoxy-4-oxo-
| Molecular Formula | C19H20FN3O5 |
| Molecular Weight | 389.1387 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 103.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 4 |
| Exact Mass | 389.1387 Da |
| Heavy Atoms | 28 |
| Complexity | 712.0 |
| SMILES | COC1=C2C(=CC(=C1N3CCC(=NO)CC3)F)C(=O)C(=CN2C4CC4)C(=O)O |
| InChIKey | PEQPFISMWLZTJZ-UHFFFAOYSA-N |
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:229862. The TPSA of 103.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:229862. Following Lipinski's Rule of Five, RefChem:229862 has 2 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of RefChem:229862 is 150008-26-7.
The molecular formula of RefChem:229862 is C19H20FN3O5.
The molecular weight of RefChem:229862 is 389.1387 g/mol.
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