N-(2-chloro-4-sulfamoylphenyl)quinoline-8-sulfonamide

C15H12ClN3O4S2 — CID 35767151

IUPACN-(2-chloro-4-sulfamoylphenyl)quinoline-8-sulfonamide
SMILESNS(=O)(=O)c1ccc(NS(=O)(=O)c2cccc3cccnc23)c(Cl)c1
InChIInChI=1S/C15H12ClN3O4S2/c16-12-9-11(24(17,20)21)6-7-13(12)19-25(22,23)14-5-1-3-10-4-2-8-18-15(10)14/h1-9,19H,(H2,17,20,21)
InChIKeyOCGKGCSWUODRFP-UHFFFAOYSA-N
MW397.87 g/mol
LogP2.34
Rot. Bonds4

About N-(2-chloro-4-sulfamoylphenyl)quinoline-8-sulfonamide

N-(2-chloro-4-sulfamoylphenyl)quinoline-8-sulfonamide (PubChem CID 35767151) has the molecular formula C15H12ClN3O4S2 and a molecular weight of 397.87 g/mol. Its IUPAC name is N-(2-chloro-4-sulfamoylphenyl)quinoline-8-sulfonamide.

Molecular Properties

Compound NameN-(2-chloro-4-sulfamoylphenyl)quinoline-8-sulfonamide
PubChem CID35767151
Molecular FormulaC15H12ClN3O4S2
Molecular Weight397.87 g/mol
Exact Mass397.00
IUPAC NameN-(2-chloro-4-sulfamoylphenyl)quinoline-8-sulfonamide
SMILESNS(=O)(=O)c1ccc(NS(=O)(=O)c2cccc3cccnc23)c(Cl)c1
InChIInChI=1S/C15H12ClN3O4S2/c16-12-9-11(24(17,20)21)6-7-13(12)19-25(22,23)14-5-1-3-10-4-2-8-18-15(10)14/h1-9,19H,(H2,17,20,21)
InChIKeyOCGKGCSWUODRFP-UHFFFAOYSA-N
XLogP2.34
TPSA119.22 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500397.87
LogP ≤ 52.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2,6-dichlorophenyl)quinoline-8-sulfonamide
CID 5068800
N-(2-bromo-4-methylphenyl)quinoline-8-sulfonamide
CID 4197183
N-(2,4-dimethylphenyl)quinoline-8-sulfonamide
CID 4067742
2-chloro-N-quinolin-8-ylpyridine-3-sulfonamide
CID 24621400
N-(2-fluoro-4-iodophenyl)quinoline-8-sulfonamide
CID 5007550
N-(2,5-difluorophenyl)quinoline-8-sulfonamide
CID 22773481
2-hydroxy-N-quinolin-8-ylbenzenesulfonamide
CID 1380884
2-chloro-4-methyl-N-quinolin-8-ylbenzenesulfonamide
CID 24629216
5-fluoro-2-(quinolin-8-ylsulfonylamino)benzoic acid
CID 22398672
N-(2-methyl-5-nitrophenyl)quinoline-8-sulfonamide
CID 4307070
4-iodo-N-quinolin-8-ylbenzenesulfonamide
CID 25048748
N-(4-bromophenyl)quinoline-8-sulfonamide
CID 3423367

Frequently Asked Questions

What is the IUPAC name of N-(2-chloro-4-sulfamoylphenyl)quinoline-8-sulfonamide?
The IUPAC name of N-(2-chloro-4-sulfamoylphenyl)quinoline-8-sulfonamide (CID 35767151) is N-(2-chloro-4-sulfamoylphenyl)quinoline-8-sulfonamide.
What is the SMILES notation for N-(2-chloro-4-sulfamoylphenyl)quinoline-8-sulfonamide?
The canonical SMILES for N-(2-chloro-4-sulfamoylphenyl)quinoline-8-sulfonamide is NS(=O)(=O)c1ccc(NS(=O)(=O)c2cccc3cccnc23)c(Cl)c1.
What is the InChIKey of N-(2-chloro-4-sulfamoylphenyl)quinoline-8-sulfonamide?
The InChIKey is OCGKGCSWUODRFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12ClN3O4S2/c16-12-9-11(24(17,20)21)6-7-13(12)19-25(22,23)14-5-1-3-10-4-2-8-18-15(10)14/h1-9,19H,(H2,17,20,21).
What are the key properties of N-(2-chloro-4-sulfamoylphenyl)quinoline-8-sulfonamide?
N-(2-chloro-4-sulfamoylphenyl)quinoline-8-sulfonamide has a molecular weight of 397.87 g/mol, XLogP of 2.34, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chloro-4-sulfamoylphenyl)quinoline-8-sulfonamide is sourced from PubChem (CID 35767151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).