N-(3-bromo-5-fluoro-2-pyridinyl)-2-chlorobenzenesulfonamide

C11H7BrClFN2O2S — CID 110504689

IUPACN-(3-bromo-5-fluoro-2-pyridinyl)-2-chlorobenzenesulfonamide
SMILESO=S(=O)(Nc1ncc(F)cc1Br)c1ccccc1Cl
InChIInChI=1S/C11H7BrClFN2O2S/c12-8-5-7(14)6-15-11(8)16-19(17,18)10-4-2-1-3-9(10)13/h1-6H,(H,15,16)
InChIKeyWVWQPWANQWCUIZ-UHFFFAOYSA-N
MW365.61 g/mol
LogP3.44
Rot. Bonds3

About N-(3-bromo-5-fluoro-2-pyridinyl)-2-chlorobenzenesulfonamide

N-(3-bromo-5-fluoro-2-pyridinyl)-2-chlorobenzenesulfonamide (PubChem CID 110504689) has the molecular formula C11H7BrClFN2O2S and a molecular weight of 365.61 g/mol. Its IUPAC name is N-(3-bromo-5-fluoro-2-pyridinyl)-2-chlorobenzenesulfonamide.

Molecular Properties

Compound NameN-(3-bromo-5-fluoro-2-pyridinyl)-2-chlorobenzenesulfonamide
PubChem CID110504689
Molecular FormulaC11H7BrClFN2O2S
Molecular Weight365.61 g/mol
Exact Mass363.91
IUPAC NameN-(3-bromo-5-fluoro-2-pyridinyl)-2-chlorobenzenesulfonamide
SMILESO=S(=O)(Nc1ncc(F)cc1Br)c1ccccc1Cl
InChIInChI=1S/C11H7BrClFN2O2S/c12-8-5-7(14)6-15-11(8)16-19(17,18)10-4-2-1-3-9(10)13/h1-6H,(H,15,16)
InChIKeyWVWQPWANQWCUIZ-UHFFFAOYSA-N
XLogP3.44
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.61
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(5-amino-3-bromo-2-pyridinyl)-2-chloro-5-fluorobenzenesulfonamide
CID 105399568
N-(3-bromo-5-fluoro-2-pyridinyl)-3,4-dimethylbenzenesulfonamide
CID 110504674
N-(7-bromo-5-fluoropyrrolo[2,1-f][1,2,4]triazin-4-yl)-2-chlorobenzenesulfonamide
CID 156822765
N-(2-bromophenyl)-2-chlorobenzenesulfonamide
CID 4816661
2-chloro-N-(5-methyl-3-pyridinyl)benzenesulfonamide
CID 110727391
2-bromo-N-(2-bromo-6-chloro-4-fluorophenyl)benzenesulfonamide
CID 104922632
N-(5-bromo-3-methyl-2-pyridinyl)-2-chloro-5-fluorobenzenesulfonamide
CID 115731782
N-(2-bromo-6-chloro-4-fluorophenyl)-2-fluorobenzenesulfonamide
CID 104922640
2-chloro-N-(3-methyl-2-pyridinyl)benzenesulfonamide
CID 5147339
2-chloro-N-[6-[(4-fluorophenyl)methylamino]-3-pyridinyl]benzenesulfonamide
CID 113012187
N-(2-bromo-6-chloro-4-fluorophenyl)-2-hydrazinylbenzenesulfonamide
CID 107613420
2-chloro-N-(3-chloro-6,7-dimethylquinoxalin-2-yl)benzenesulfonamide
CID 86657925

Frequently Asked Questions

What is the IUPAC name of N-(3-bromo-5-fluoro-2-pyridinyl)-2-chlorobenzenesulfonamide?
The IUPAC name of N-(3-bromo-5-fluoro-2-pyridinyl)-2-chlorobenzenesulfonamide (CID 110504689) is N-(3-bromo-5-fluoro-2-pyridinyl)-2-chlorobenzenesulfonamide.
What is the SMILES notation for N-(3-bromo-5-fluoro-2-pyridinyl)-2-chlorobenzenesulfonamide?
The canonical SMILES for N-(3-bromo-5-fluoro-2-pyridinyl)-2-chlorobenzenesulfonamide is O=S(=O)(Nc1ncc(F)cc1Br)c1ccccc1Cl.
What is the InChIKey of N-(3-bromo-5-fluoro-2-pyridinyl)-2-chlorobenzenesulfonamide?
The InChIKey is WVWQPWANQWCUIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7BrClFN2O2S/c12-8-5-7(14)6-15-11(8)16-19(17,18)10-4-2-1-3-9(10)13/h1-6H,(H,15,16).
What are the key properties of N-(3-bromo-5-fluoro-2-pyridinyl)-2-chlorobenzenesulfonamide?
N-(3-bromo-5-fluoro-2-pyridinyl)-2-chlorobenzenesulfonamide has a molecular weight of 365.61 g/mol, XLogP of 3.44, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-bromo-5-fluoro-2-pyridinyl)-2-chlorobenzenesulfonamide is sourced from PubChem (CID 110504689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).