5-bromo-2-chloro-N-(3,5-dichloro-4-fluorophenyl)pyridine-3-sulfonamide

C11H5BrCl3FN2O2S — CID 107573401

IUPAC5-bromo-2-chloro-N-(3,5-dichloro-4-fluorophenyl)pyridine-3-sulfonamide
SMILESO=S(=O)(Nc1cc(Cl)c(F)c(Cl)c1)c1cc(Br)cnc1Cl
InChIInChI=1S/C11H5BrCl3FN2O2S/c12-5-1-9(11(15)17-4-5)21(19,20)18-6-2-7(13)10(16)8(14)3-6/h1-4,18H
InChIKeyZAYYZIWFOCEOHG-UHFFFAOYSA-N
MW434.50 g/mol
LogP4.74
Rot. Bonds3

About 5-bromo-2-chloro-N-(3,5-dichloro-4-fluorophenyl)pyridine-3-sulfonamide

5-bromo-2-chloro-N-(3,5-dichloro-4-fluorophenyl)pyridine-3-sulfonamide (PubChem CID 107573401) has the molecular formula C11H5BrCl3FN2O2S and a molecular weight of 434.50 g/mol. Its IUPAC name is 5-bromo-2-chloro-N-(3,5-dichloro-4-fluorophenyl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name5-bromo-2-chloro-N-(3,5-dichloro-4-fluorophenyl)pyridine-3-sulfonamide
PubChem CID107573401
Molecular FormulaC11H5BrCl3FN2O2S
Molecular Weight434.50 g/mol
Exact Mass431.83
IUPAC Name5-bromo-2-chloro-N-(3,5-dichloro-4-fluorophenyl)pyridine-3-sulfonamide
SMILESO=S(=O)(Nc1cc(Cl)c(F)c(Cl)c1)c1cc(Br)cnc1Cl
InChIInChI=1S/C11H5BrCl3FN2O2S/c12-5-1-9(11(15)17-4-5)21(19,20)18-6-2-7(13)10(16)8(14)3-6/h1-4,18H
InChIKeyZAYYZIWFOCEOHG-UHFFFAOYSA-N
XLogP4.74
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500434.50
LogP ≤ 54.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}

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Related Compounds

6-chloro-N-(2-fluorophenyl)pyridine-3-sulfonamide
CID 2683449
6-chloro-N-(2,6-difluorophenyl)pyridine-3-sulfonamide
CID 9115009
3-Pyridinesulfonamide, 4-((3,5-dichlorophenyl)amino)-
CID 3040403
5-Bromo-6-chloropyridine-3-sulfonamide
CID 4730022
5-Bromo-2-chloropyridine-3-sulfonamide
CID 60779916
N-(3-chloro-4-fluorophenyl)pyridine-3-sulfonamide
CID 3567298
N-(4-bromo-2-fluorophenyl)pyridine-3-sulfonamide
CID 24699348
N-(3-chlorophenyl)pyridine-3-sulfonamide
CID 5253738
N-(2-bromo-3-fluorophenyl)pyridine-2-sulfonamide
CID 134843243
N-(2-bromophenyl)pyridine-3-sulfonamide
CID 3619502
N-(2-chlorophenyl)pyridine-3-sulfonamide
CID 4641874
2-amino-5-bromo-N-(4-chloro-2-fluorophenyl)pyridine-3-sulfonamide
CID 22515911

Frequently Asked Questions

What is the IUPAC name of 5-bromo-2-chloro-N-(3,5-dichloro-4-fluorophenyl)pyridine-3-sulfonamide?
The IUPAC name of 5-bromo-2-chloro-N-(3,5-dichloro-4-fluorophenyl)pyridine-3-sulfonamide (CID 107573401) is 5-bromo-2-chloro-N-(3,5-dichloro-4-fluorophenyl)pyridine-3-sulfonamide.
What is the SMILES notation for 5-bromo-2-chloro-N-(3,5-dichloro-4-fluorophenyl)pyridine-3-sulfonamide?
The canonical SMILES for 5-bromo-2-chloro-N-(3,5-dichloro-4-fluorophenyl)pyridine-3-sulfonamide is O=S(=O)(Nc1cc(Cl)c(F)c(Cl)c1)c1cc(Br)cnc1Cl.
What is the InChIKey of 5-bromo-2-chloro-N-(3,5-dichloro-4-fluorophenyl)pyridine-3-sulfonamide?
The InChIKey is ZAYYZIWFOCEOHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H5BrCl3FN2O2S/c12-5-1-9(11(15)17-4-5)21(19,20)18-6-2-7(13)10(16)8(14)3-6/h1-4,18H.
What are the key properties of 5-bromo-2-chloro-N-(3,5-dichloro-4-fluorophenyl)pyridine-3-sulfonamide?
5-bromo-2-chloro-N-(3,5-dichloro-4-fluorophenyl)pyridine-3-sulfonamide has a molecular weight of 434.50 g/mol, XLogP of 4.74, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-2-chloro-N-(3,5-dichloro-4-fluorophenyl)pyridine-3-sulfonamide is sourced from PubChem (CID 107573401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).