8-hydroxyquinoline-4-sulfonyl chloride

C9H6ClNO3S — CID 55280284

IUPAC8-hydroxyquinoline-4-sulfonyl chloride
SMILESO=S(=O)(Cl)c1ccnc2c(O)cccc12
InChIInChI=1S/C9H6ClNO3S/c10-15(13,14)8-4-5-11-9-6(8)2-1-3-7(9)12/h1-5,12H
InChIKeyXQMCTENSIXHCOL-UHFFFAOYSA-N
MW243.67 g/mol
LogP1.87
Rot. Bonds1

About 8-hydroxyquinoline-4-sulfonyl chloride

8-hydroxyquinoline-4-sulfonyl chloride (PubChem CID 55280284) has the molecular formula C9H6ClNO3S and a molecular weight of 243.67 g/mol. Its IUPAC name is 8-hydroxyquinoline-4-sulfonyl chloride.

Molecular Properties

Compound Name8-hydroxyquinoline-4-sulfonyl chloride
PubChem CID55280284
Molecular FormulaC9H6ClNO3S
Molecular Weight243.67 g/mol
Exact Mass242.98
IUPAC Name8-hydroxyquinoline-4-sulfonyl chloride
SMILESO=S(=O)(Cl)c1ccnc2c(O)cccc12
InChIInChI=1S/C9H6ClNO3S/c10-15(13,14)8-4-5-11-9-6(8)2-1-3-7(9)12/h1-5,12H
InChIKeyXQMCTENSIXHCOL-UHFFFAOYSA-N
XLogP1.87
TPSA67.26 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.67
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 8-hydroxyquinoline-4-sulfonyl 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-hydroxyquinoline-5-sulfonate
CID 5260546
CID 173241757
CID 173241757
sodium 8-hydroxyquinoline-5-sulfonate
CID 23719445
8-hydroxy-N-(3-methoxyphenyl)quinoline-4-sulfonamide
CID 11158687
5-chloroquinoline-8-sulfonyl chloride
CID 4206949
8-propan-2-yloxyquinoline-5-sulfonyl chloride
CID 43115660
3-(5-chlorosulfonylquinolin-8-yl)oxypropanoic acid
CID 43115657
8-(1-cyanopropoxy)quinoline-5-sulfonyl chloride
CID 82910374
7-fluoro-8-methylquinoline-5-sulfonyl chloride
CID 54593009
5-[2-(trifluoromethyl)phenyl]sulfonylquinolin-8-ol
CID 122441904
5-[(4-methylphenyl)methylsulfonyl]quinolin-8-ol
CID 122442023
CID 172791001
CID 172791001

Frequently Asked Questions

What is the IUPAC name of 8-hydroxyquinoline-4-sulfonyl chloride?
The IUPAC name of 8-hydroxyquinoline-4-sulfonyl chloride (CID 55280284) is 8-hydroxyquinoline-4-sulfonyl chloride.
What is the SMILES notation for 8-hydroxyquinoline-4-sulfonyl chloride?
The canonical SMILES for 8-hydroxyquinoline-4-sulfonyl chloride is O=S(=O)(Cl)c1ccnc2c(O)cccc12.
What is the InChIKey of 8-hydroxyquinoline-4-sulfonyl chloride?
The InChIKey is XQMCTENSIXHCOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H6ClNO3S/c10-15(13,14)8-4-5-11-9-6(8)2-1-3-7(9)12/h1-5,12H.
What are the key properties of 8-hydroxyquinoline-4-sulfonyl chloride?
8-hydroxyquinoline-4-sulfonyl chloride has a molecular weight of 243.67 g/mol, XLogP of 1.87, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-hydroxyquinoline-4-sulfonyl chloride is sourced from PubChem (CID 55280284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).