4-bromo-N-(5-bromo-2-chlorophenyl)-2,6-dichlorobenzenesulfonamide

C12H6Br2Cl3NO2S — CID 63421665

IUPAC4-bromo-N-(5-bromo-2-chlorophenyl)-2,6-dichlorobenzenesulfonamide
SMILESO=S(=O)(Nc1cc(Br)ccc1Cl)c1c(Cl)cc(Br)cc1Cl
InChIInChI=1S/C12H6Br2Cl3NO2S/c13-6-1-2-8(15)11(5-6)18-21(19,20)12-9(16)3-7(14)4-10(12)17/h1-5,18H
InChIKeyXEOPEJQGKQWWDC-UHFFFAOYSA-N
MW494.42 g/mol
LogP5.97
Rot. Bonds3

About 4-bromo-N-(5-bromo-2-chlorophenyl)-2,6-dichlorobenzenesulfonamide

4-bromo-N-(5-bromo-2-chlorophenyl)-2,6-dichlorobenzenesulfonamide (PubChem CID 63421665) has the molecular formula C12H6Br2Cl3NO2S and a molecular weight of 494.42 g/mol. Its IUPAC name is 4-bromo-N-(5-bromo-2-chlorophenyl)-2,6-dichlorobenzenesulfonamide.

Molecular Properties

Compound Name4-bromo-N-(5-bromo-2-chlorophenyl)-2,6-dichlorobenzenesulfonamide
PubChem CID63421665
Molecular FormulaC12H6Br2Cl3NO2S
Molecular Weight494.42 g/mol
Exact Mass490.76
IUPAC Name4-bromo-N-(5-bromo-2-chlorophenyl)-2,6-dichlorobenzenesulfonamide
SMILESO=S(=O)(Nc1cc(Br)ccc1Cl)c1c(Cl)cc(Br)cc1Cl
InChIInChI=1S/C12H6Br2Cl3NO2S/c13-6-1-2-8(15)11(5-6)18-21(19,20)12-9(16)3-7(14)4-10(12)17/h1-5,18H
InChIKeyXEOPEJQGKQWWDC-UHFFFAOYSA-N
XLogP5.97
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500494.42
LogP ≤ 55.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-bromo-N-(4-bromo-2-chlorophenyl)-2,6-dichlorobenzenesulfonamide
CID 60640138
4-bromo-2,6-dichloro-N-(4-chloro-3-pyridinyl)benzenesulfonamide
CID 83167871
N-(5-bromo-2-chlorophenyl)benzenesulfonamide
CID 62909796
4-bromo-2,6-dichloro-N-(2-methylphenyl)benzenesulfonamide
CID 47104330
4-bromo-N-(2-bromo-4-methylphenyl)-2,6-dichlorobenzenesulfonamide
CID 28829086
2-amino-N-(5-bromo-2-chlorophenyl)-3,6-dimethylbenzenesulfonamide
CID 103171459
4-bromo-N-(2-bromo-5-methylphenyl)-2,6-dichlorobenzenesulfonamide
CID 82747202
4-bromo-2,6-dichloro-N-(2-methylsulfanylphenyl)benzenesulfonamide
CID 60640706
4-amino-2,6-dichloro-N-(2,4-dibromophenyl)benzenesulfonamide
CID 61471931
4-bromo-2,6-dichloro-N-(4-iodo-2-methylphenyl)benzenesulfonamide
CID 60640804
4-bromo-2,6-dichloro-N-(3,5-dichlorophenyl)benzenesulfonamide
CID 60640543
N-(5-bromo-2-chlorophenyl)thiophene-2-sulfonamide
CID 55132063

Frequently Asked Questions

What is the IUPAC name of 4-bromo-N-(5-bromo-2-chlorophenyl)-2,6-dichlorobenzenesulfonamide?
The IUPAC name of 4-bromo-N-(5-bromo-2-chlorophenyl)-2,6-dichlorobenzenesulfonamide (CID 63421665) is 4-bromo-N-(5-bromo-2-chlorophenyl)-2,6-dichlorobenzenesulfonamide.
What is the SMILES notation for 4-bromo-N-(5-bromo-2-chlorophenyl)-2,6-dichlorobenzenesulfonamide?
The canonical SMILES for 4-bromo-N-(5-bromo-2-chlorophenyl)-2,6-dichlorobenzenesulfonamide is O=S(=O)(Nc1cc(Br)ccc1Cl)c1c(Cl)cc(Br)cc1Cl.
What is the InChIKey of 4-bromo-N-(5-bromo-2-chlorophenyl)-2,6-dichlorobenzenesulfonamide?
The InChIKey is XEOPEJQGKQWWDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H6Br2Cl3NO2S/c13-6-1-2-8(15)11(5-6)18-21(19,20)12-9(16)3-7(14)4-10(12)17/h1-5,18H.
What are the key properties of 4-bromo-N-(5-bromo-2-chlorophenyl)-2,6-dichlorobenzenesulfonamide?
4-bromo-N-(5-bromo-2-chlorophenyl)-2,6-dichlorobenzenesulfonamide has a molecular weight of 494.42 g/mol, XLogP of 5.97, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-N-(5-bromo-2-chlorophenyl)-2,6-dichlorobenzenesulfonamide is sourced from PubChem (CID 63421665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).