N-(2-bromo-4,6-difluorophenyl)-6-oxo-1H-pyridine-3-sulfonamide

C11H7BrF2N2O3S — CID 43629170

IUPACN-(2-bromo-4,6-difluorophenyl)-6-oxo-1H-pyridine-3-sulfonamide
SMILESO=c1ccc(S(=O)(=O)Nc2c(F)cc(F)cc2Br)c[nH]1
InChIInChI=1S/C11H7BrF2N2O3S/c12-8-3-6(13)4-9(14)11(8)16-20(18,19)7-1-2-10(17)15-5-7/h1-5,16H,(H,15,17)
InChIKeyMDUQQSVZQBDELK-UHFFFAOYSA-N
MW365.16 g/mol
LogP2.22
Rot. Bonds3

About N-(2-bromo-4,6-difluorophenyl)-6-oxo-1H-pyridine-3-sulfonamide

N-(2-bromo-4,6-difluorophenyl)-6-oxo-1H-pyridine-3-sulfonamide (PubChem CID 43629170) has the molecular formula C11H7BrF2N2O3S and a molecular weight of 365.16 g/mol. Its IUPAC name is N-(2-bromo-4,6-difluorophenyl)-6-oxo-1H-pyridine-3-sulfonamide.

Molecular Properties

Compound NameN-(2-bromo-4,6-difluorophenyl)-6-oxo-1H-pyridine-3-sulfonamide
PubChem CID43629170
Molecular FormulaC11H7BrF2N2O3S
Molecular Weight365.16 g/mol
Exact Mass363.93
IUPAC NameN-(2-bromo-4,6-difluorophenyl)-6-oxo-1H-pyridine-3-sulfonamide
SMILESO=c1ccc(S(=O)(=O)Nc2c(F)cc(F)cc2Br)c[nH]1
InChIInChI=1S/C11H7BrF2N2O3S/c12-8-3-6(13)4-9(14)11(8)16-20(18,19)7-1-2-10(17)15-5-7/h1-5,16H,(H,15,17)
InChIKeyMDUQQSVZQBDELK-UHFFFAOYSA-N
XLogP2.22
TPSA79.03 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.16
LogP ≤ 52.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(2-bromo-4,6-difluorophenyl)-6-oxo-1H-pyridine-3-sulfonamide 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

N-(5-bromo-2,4-difluorophenyl)-6-oxo-1H-pyridine-3-sulfonamide
CID 102854641
6-oxo-N-(2,3,5,6-tetrafluorophenyl)-1H-pyridine-3-sulfonamide
CID 107642714
N-(3-bromo-4-fluorophenyl)-6-oxo-1H-pyridine-3-sulfonamide
CID 104780385
3-amino-N-(2-bromo-4,6-difluorophenyl)-4-fluorobenzenesulfonamide
CID 43168233
3-amino-N-(2-bromo-4,6-difluorophenyl)-4-chlorobenzenesulfonamide
CID 43347515
3-amino-N-(2-bromo-4,6-difluorophenyl)-5-fluorobenzenesulfonamide
CID 63322042
N-(4-fluoro-2-methylphenyl)-6-oxo-1H-pyridine-3-sulfonamide
CID 43629227
N-(2,3-difluorophenyl)-6-oxo-1H-pyridine-3-sulfonamide
CID 61075597
N-(2-bromo-4,6-difluorophenyl)-2-(methylamino)benzenesulfonamide
CID 62142695
N-[1-(2,4-difluorophenyl)ethyl]-6-oxo-1H-pyridine-3-sulfonamide
CID 61249942
N-(2-bromo-4,6-difluorophenyl)-2,6-dichlorobenzenesulfonamide
CID 112769161
5-bromo-N-(2-bromo-4,6-difluorophenyl)-2-methylbenzenesulfonamide
CID 60661133

Frequently Asked Questions

What is the IUPAC name of N-(2-bromo-4,6-difluorophenyl)-6-oxo-1H-pyridine-3-sulfonamide?
The IUPAC name of N-(2-bromo-4,6-difluorophenyl)-6-oxo-1H-pyridine-3-sulfonamide (CID 43629170) is N-(2-bromo-4,6-difluorophenyl)-6-oxo-1H-pyridine-3-sulfonamide.
What is the SMILES notation for N-(2-bromo-4,6-difluorophenyl)-6-oxo-1H-pyridine-3-sulfonamide?
The canonical SMILES for N-(2-bromo-4,6-difluorophenyl)-6-oxo-1H-pyridine-3-sulfonamide is O=c1ccc(S(=O)(=O)Nc2c(F)cc(F)cc2Br)c[nH]1.
What is the InChIKey of N-(2-bromo-4,6-difluorophenyl)-6-oxo-1H-pyridine-3-sulfonamide?
The InChIKey is MDUQQSVZQBDELK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7BrF2N2O3S/c12-8-3-6(13)4-9(14)11(8)16-20(18,19)7-1-2-10(17)15-5-7/h1-5,16H,(H,15,17).
What are the key properties of N-(2-bromo-4,6-difluorophenyl)-6-oxo-1H-pyridine-3-sulfonamide?
N-(2-bromo-4,6-difluorophenyl)-6-oxo-1H-pyridine-3-sulfonamide has a molecular weight of 365.16 g/mol, XLogP of 2.22, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromo-4,6-difluorophenyl)-6-oxo-1H-pyridine-3-sulfonamide is sourced from PubChem (CID 43629170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).