N-(7-chloro-2-oxo-3-phenyl-1H-quinolin-4-yl)benzenesulfonamide

C21H15ClN2O3S — CID 10501747

IUPACN-(7-chloro-2-oxo-3-phenyl-1H-quinolin-4-yl)benzenesulfonamide
SMILESO=c1[nH]c2cc(Cl)ccc2c(NS(=O)(=O)c2ccccc2)c1-c1ccccc1
InChIInChI=1S/C21H15ClN2O3S/c22-15-11-12-17-18(13-15)23-21(25)19(14-7-3-1-4-8-14)20(17)24-28(26,27)16-9-5-2-6-10-16/h1-13H,(H2,23,24,25)
InChIKeyABCYBDLMCHAQLQ-UHFFFAOYSA-N
MW410.88 g/mol
LogP4.65
Rot. Bonds4

About N-(7-chloro-2-oxo-3-phenyl-1H-quinolin-4-yl)benzenesulfonamide

N-(7-chloro-2-oxo-3-phenyl-1H-quinolin-4-yl)benzenesulfonamide (PubChem CID 10501747) has the molecular formula C21H15ClN2O3S and a molecular weight of 410.88 g/mol. Its IUPAC name is N-(7-chloro-2-oxo-3-phenyl-1H-quinolin-4-yl)benzenesulfonamide.

Molecular Properties

Compound NameN-(7-chloro-2-oxo-3-phenyl-1H-quinolin-4-yl)benzenesulfonamide
PubChem CID10501747
Molecular FormulaC21H15ClN2O3S
Molecular Weight410.88 g/mol
Exact Mass410.05
IUPAC NameN-(7-chloro-2-oxo-3-phenyl-1H-quinolin-4-yl)benzenesulfonamide
SMILESO=c1[nH]c2cc(Cl)ccc2c(NS(=O)(=O)c2ccccc2)c1-c1ccccc1
InChIInChI=1S/C21H15ClN2O3S/c22-15-11-12-17-18(13-15)23-21(25)19(14-7-3-1-4-8-14)20(17)24-28(26,27)16-9-5-2-6-10-16/h1-13H,(H2,23,24,25)
InChIKeyABCYBDLMCHAQLQ-UHFFFAOYSA-N
XLogP4.65
TPSA79.03 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.88
LogP ≤ 54.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-chloro-3-[(2,5-dimethylphenyl)sulfamoyl]-N-(2-phenylphenyl)benzamide
CID 2228302
N-benzyl-2-(benzylamino)-4-chloro-5-sulfamoylbenzamide
CID 126508254
N-(3-chlorophenyl)-2-oxo-3,4-dihydro-1H-quinoline-6-sulfonamide
CID 3647906
2,4-dichloro-N-[4-(phenylsulfamoyl)phenyl]benzamide
CID 5157334
N-(2-chlorobenzyl)-2-[methyl(phenylsulfonyl)amino]benzamide
CID 1019165
3-chloro-N-(4-sulfamoylphenyl)benzamide
CID 2455664
N-{2-[(allylamino)carbonyl]phenyl}-3-(anilinosulfonyl)-4-chlorobenzamide
CID 2237563
4-chloro-N-(3-sulfamoylphenyl)benzamide
CID 3564294
3-(7-Chloro-2-oxo-3-phenyl-1,2-dihydro-quinolin-4-yl)-propionamide
CID 10568175
N-(7-Chloro-2-oxo-3-phenyl-1,2-dihydro-quinolin-4-yl)-methanesulfonamide
CID 10665443
N-[4-(benzenesulfonamido)phenyl]-2-chlorobenzamide
CID 2311681
2-(4-chlorophenyl)-N-(4-sulfamoylphenyl)acetamide
CID 670087

Frequently Asked Questions

What is the IUPAC name of N-(7-chloro-2-oxo-3-phenyl-1H-quinolin-4-yl)benzenesulfonamide?
The IUPAC name of N-(7-chloro-2-oxo-3-phenyl-1H-quinolin-4-yl)benzenesulfonamide (CID 10501747) is N-(7-chloro-2-oxo-3-phenyl-1H-quinolin-4-yl)benzenesulfonamide.
What is the SMILES notation for N-(7-chloro-2-oxo-3-phenyl-1H-quinolin-4-yl)benzenesulfonamide?
The canonical SMILES for N-(7-chloro-2-oxo-3-phenyl-1H-quinolin-4-yl)benzenesulfonamide is O=c1[nH]c2cc(Cl)ccc2c(NS(=O)(=O)c2ccccc2)c1-c1ccccc1.
What is the InChIKey of N-(7-chloro-2-oxo-3-phenyl-1H-quinolin-4-yl)benzenesulfonamide?
The InChIKey is ABCYBDLMCHAQLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H15ClN2O3S/c22-15-11-12-17-18(13-15)23-21(25)19(14-7-3-1-4-8-14)20(17)24-28(26,27)16-9-5-2-6-10-16/h1-13H,(H2,23,24,25).
What are the key properties of N-(7-chloro-2-oxo-3-phenyl-1H-quinolin-4-yl)benzenesulfonamide?
N-(7-chloro-2-oxo-3-phenyl-1H-quinolin-4-yl)benzenesulfonamide has a molecular weight of 410.88 g/mol, XLogP of 4.65, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(7-chloro-2-oxo-3-phenyl-1H-quinolin-4-yl)benzenesulfonamide is sourced from PubChem (CID 10501747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).