TL;DR: Quinoline, 8-[(chloromethyl)thio]- (CAS 109876-46-2) is a chemical compound with molecular formula C10H8ClNS and molecular weight 209.00659 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
8-(chloromethylsulfanyl)quinoline
Also Known As: 8-(chloromethylsulfanyl)quinoline, Quinoline, 8-[(chloromethyl)thio]-, 8-((chloromethyl)thio)quinoline
| Molecular Formula | C10H8ClNS |
| Molecular Weight | 209.00659 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 38.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 209.00659 Da |
| Heavy Atoms | 13 |
| Complexity | 165.0 |
| SMILES | C1=CC2=C(C(=C1)SCCl)N=CC=C2 |
| InChIKey | OWTCJWRDURRTKY-UHFFFAOYSA-N |
The XLogP value of 3.0 indicates that Quinoline, 8-[(chloromethyl)thio]- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.2 Ų, Quinoline, 8-[(chloromethyl)thio]- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Quinoline, 8-[(chloromethyl)thio]- has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Quinoline, 8-[(chloromethyl)thio]- is 109876-46-2.
The molecular formula of Quinoline, 8-[(chloromethyl)thio]- is C10H8ClNS.
The molecular weight of Quinoline, 8-[(chloromethyl)thio]- is 209.00659 g/mol.
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