2-quinolin-8-ylbenzenesulfonyl chloride

C15H10ClNO2S — CID 139939947

IUPAC2-quinolin-8-ylbenzenesulfonyl chloride
SMILESO=S(=O)(Cl)c1ccccc1-c1cccc2cccnc12
InChIInChI=1S/C15H10ClNO2S/c16-20(18,19)14-9-2-1-7-12(14)13-8-3-5-11-6-4-10-17-15(11)13/h1-10H
InChIKeyXPMHBNQPDRHQBG-UHFFFAOYSA-N
MW303.77 g/mol
LogP3.83
Rot. Bonds2

About 2-quinolin-8-ylbenzenesulfonyl chloride

2-quinolin-8-ylbenzenesulfonyl chloride (PubChem CID 139939947) has the molecular formula C15H10ClNO2S and a molecular weight of 303.77 g/mol. Its IUPAC name is 2-quinolin-8-ylbenzenesulfonyl chloride.

Molecular Properties

Compound Name2-quinolin-8-ylbenzenesulfonyl chloride
PubChem CID139939947
Molecular FormulaC15H10ClNO2S
Molecular Weight303.77 g/mol
Exact Mass303.01
IUPAC Name2-quinolin-8-ylbenzenesulfonyl chloride
SMILESO=S(=O)(Cl)c1ccccc1-c1cccc2cccnc12
InChIInChI=1S/C15H10ClNO2S/c16-20(18,19)14-9-2-1-7-12(14)13-8-3-5-11-6-4-10-17-15(11)13/h1-10H
InChIKeyXPMHBNQPDRHQBG-UHFFFAOYSA-N
XLogP3.83
TPSA47.03 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.77
LogP ≤ 53.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-quinolin-8-ylbenzenesulfonyl chloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

8-(4-quinolin-8-ylsulfonylpiperazin-1-yl)sulfonylquinoline
CID 4173018
N-(methyl-oxo-quinolin-8-yl-λ6-sulfanylidene)sulfamoyl chloride
CID 125424737
8-pyridin-2-ylquinoline
CID 10982041
(2-quinolin-8-ylphenyl) trifluoromethanesulfonate
CID 87290128
mercury;8-phenylquinoline;hydrate
CID 174770535
8-methylsulfanylsulfonylquinoline
CID 913226
8-(3-quinolin-8-ylphenyl)quinoline
CID 90955641
oxygen(2-);1,10-phenanthroline;vanadium(4+);sulfate
CID 11595345
8-piperidin-1-ylsulfonylquinoline
CID 768759
8-(9H-fluoren-1-yl)quinoline
CID 151254514
CID 58385596
CID 58385596
europium;1,10-phenanthroline
CID 20606755

Frequently Asked Questions

What is the IUPAC name of 2-quinolin-8-ylbenzenesulfonyl chloride?
The IUPAC name of 2-quinolin-8-ylbenzenesulfonyl chloride (CID 139939947) is 2-quinolin-8-ylbenzenesulfonyl chloride.
What is the SMILES notation for 2-quinolin-8-ylbenzenesulfonyl chloride?
The canonical SMILES for 2-quinolin-8-ylbenzenesulfonyl chloride is O=S(=O)(Cl)c1ccccc1-c1cccc2cccnc12.
What is the InChIKey of 2-quinolin-8-ylbenzenesulfonyl chloride?
The InChIKey is XPMHBNQPDRHQBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10ClNO2S/c16-20(18,19)14-9-2-1-7-12(14)13-8-3-5-11-6-4-10-17-15(11)13/h1-10H.
What are the key properties of 2-quinolin-8-ylbenzenesulfonyl chloride?
2-quinolin-8-ylbenzenesulfonyl chloride has a molecular weight of 303.77 g/mol, XLogP of 3.83, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-quinolin-8-ylbenzenesulfonyl chloride is sourced from PubChem (CID 139939947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).