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

N-(7-chloro-2-oxo-3-phenyl-1H-quinolin-4-yl)acetamide
CID 10686612
methyl 2-[(7-chloro-2-oxo-3-phenyl-1H-quinolin-4-yl)amino]-2-oxoacetate
CID 10594476
ethyl 3-[(7-chloro-2-oxo-3-phenyl-1H-quinolin-4-yl)amino]-3-oxopropanoate
CID 10500272
7-chloro-2-oxo-3-phenyl-1H-quinoline-4-carbonyl chloride
CID 10495745
N-(4-chloro-2,6-dimethylphenyl)benzenesulfonamide
CID 3370012
2-[(7-chloro-2-oxo-3-phenyl-1H-quinolin-4-yl)oxy]acetamide
CID 10711401
N-(6-chloro-2-oxo-4-phenyl-1H-quinolin-3-yl)acetamide
CID 44561346
7-chloro-4-hydroxy-3-(5-phenylfuran-2-yl)-1H-quinolin-2-one
CID 54736899
N-[4-chloro-2-(3-oxo-4H-quinoxalin-2-yl)phenyl]benzenesulfonamide
CID 7187743
7-chloro-4-hydroxy-3-[4-(1-phenylethenyl)phenyl]-1H-quinolin-2-one
CID 67690532
3-(benzenesulfonyl)-6-chloro-4-phenyl-1H-quinolin-2-one;4-methyl-N-[(6-methyl-2-oxo-4-phenyl-1H-quinolin-3-yl)methyl]benzenesulfonamide
CID 157344030
3-chloro-5,7-dihydroindolo[2,3-c]quinolin-6-one
CID 71560083

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).