TL;DR: Quinoline, sulfate (1:1) (CAS 530-66-5) is a chemical compound with molecular formula C9H9NO4S and molecular weight 227.02522 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
quinoline;sulfuric acid
Also Known As: Quinoline Sulphate, QUINOLINE SULFATE, Quinoline bisulfate, Quinoline, sulfate, Quinolinium hydrogen sulphate
Top 5 of 8 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C9H9NO4S |
| Molecular Weight | 227.02522 g/mol |
| XLogP | 1.58 |
| Topological Polar Surface Area (TPSA) | 95.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 227.02522 Da |
| Heavy Atoms | 15 |
| Complexity | 193.0 |
| SMILES | C1=CC=C2C(=C1)C=CC=N2.OS(=O)(=O)O |
| InChIKey | WSZKUEZEYFNPID-UHFFFAOYSA-N |
The XLogP value of 1.58 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Quinoline, sulfate (1:1). The TPSA of 95.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Quinoline, sulfate (1:1). Following Lipinski's Rule of Five, Quinoline, sulfate (1:1) has 2 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 Quinoline, sulfate (1:1) is 530-66-5.
The molecular formula of Quinoline, sulfate (1:1) is C9H9NO4S.
The molecular weight of Quinoline, sulfate (1:1) is 227.02522 g/mol.
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