4-bromo-2,6-dichloro-N-(4-chloro-3-pyridinyl)benzenesulfonamide

C11H6BrCl3N2O2S — CID 83167871

IUPAC4-bromo-2,6-dichloro-N-(4-chloro-3-pyridinyl)benzenesulfonamide
SMILESO=S(=O)(Nc1cnccc1Cl)c1c(Cl)cc(Br)cc1Cl
InChIInChI=1S/C11H6BrCl3N2O2S/c12-6-3-8(14)11(9(15)4-6)20(18,19)17-10-5-16-2-1-7(10)13/h1-5,17H
InChIKeyPBDQSVGZIPUDEA-UHFFFAOYSA-N
MW416.51 g/mol
LogP4.61
Rot. Bonds3

About 4-bromo-2,6-dichloro-N-(4-chloro-3-pyridinyl)benzenesulfonamide

4-bromo-2,6-dichloro-N-(4-chloro-3-pyridinyl)benzenesulfonamide (PubChem CID 83167871) has the molecular formula C11H6BrCl3N2O2S and a molecular weight of 416.51 g/mol. Its IUPAC name is 4-bromo-2,6-dichloro-N-(4-chloro-3-pyridinyl)benzenesulfonamide.

Molecular Properties

Compound Name4-bromo-2,6-dichloro-N-(4-chloro-3-pyridinyl)benzenesulfonamide
PubChem CID83167871
Molecular FormulaC11H6BrCl3N2O2S
Molecular Weight416.51 g/mol
Exact Mass413.84
IUPAC Name4-bromo-2,6-dichloro-N-(4-chloro-3-pyridinyl)benzenesulfonamide
SMILESO=S(=O)(Nc1cnccc1Cl)c1c(Cl)cc(Br)cc1Cl
InChIInChI=1S/C11H6BrCl3N2O2S/c12-6-3-8(14)11(9(15)4-6)20(18,19)17-10-5-16-2-1-7(10)13/h1-5,17H
InChIKeyPBDQSVGZIPUDEA-UHFFFAOYSA-N
XLogP4.61
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500416.51
LogP ≤ 54.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-bromo-N-(5-bromo-2-chlorophenyl)-2,6-dichlorobenzenesulfonamide
CID 63421665
4-bromo-N-(4-bromo-2-chlorophenyl)-2,6-dichlorobenzenesulfonamide
CID 60640138
5-bromo-N-(4-chloro-3-pyridinyl)thiophene-2-sulfonamide
CID 83167503
4-amino-2-bromo-N-(4-chloro-3-pyridinyl)benzenesulfonamide
CID 83165562
N-(4-chloro-3-pyridinyl)-3,5-dimethylbenzenesulfonamide
CID 114051868
3-amino-2-bromo-5-chloro-N-(4-chloro-3-pyridinyl)benzenesulfonamide
CID 83166228
4-bromo-2,6-dichloro-N-(2-methylphenyl)benzenesulfonamide
CID 47104330
4-bromo-2,6-dichloro-N-(1H-pyrazol-5-yl)benzenesulfonamide
CID 61394406
4-bromo-N-(2-bromo-4-methylphenyl)-2,6-dichlorobenzenesulfonamide
CID 28829086
2,5-dichloro-N-(4-chloro-3-pyridinyl)thiophene-3-sulfonamide
CID 114051881
5-amino-2-bromo-N-(4-chloro-3-pyridinyl)-4-fluorobenzenesulfonamide
CID 83165731
N-(4-chloro-3-pyridinyl)-1,3,5-trimethylpyrazole-4-sulfonamide
CID 114051879

Frequently Asked Questions

What is the IUPAC name of 4-bromo-2,6-dichloro-N-(4-chloro-3-pyridinyl)benzenesulfonamide?
The IUPAC name of 4-bromo-2,6-dichloro-N-(4-chloro-3-pyridinyl)benzenesulfonamide (CID 83167871) is 4-bromo-2,6-dichloro-N-(4-chloro-3-pyridinyl)benzenesulfonamide.
What is the SMILES notation for 4-bromo-2,6-dichloro-N-(4-chloro-3-pyridinyl)benzenesulfonamide?
The canonical SMILES for 4-bromo-2,6-dichloro-N-(4-chloro-3-pyridinyl)benzenesulfonamide is O=S(=O)(Nc1cnccc1Cl)c1c(Cl)cc(Br)cc1Cl.
What is the InChIKey of 4-bromo-2,6-dichloro-N-(4-chloro-3-pyridinyl)benzenesulfonamide?
The InChIKey is PBDQSVGZIPUDEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H6BrCl3N2O2S/c12-6-3-8(14)11(9(15)4-6)20(18,19)17-10-5-16-2-1-7(10)13/h1-5,17H.
What are the key properties of 4-bromo-2,6-dichloro-N-(4-chloro-3-pyridinyl)benzenesulfonamide?
4-bromo-2,6-dichloro-N-(4-chloro-3-pyridinyl)benzenesulfonamide has a molecular weight of 416.51 g/mol, XLogP of 4.61, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-2,6-dichloro-N-(4-chloro-3-pyridinyl)benzenesulfonamide is sourced from PubChem (CID 83167871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).