4-bromo-N-(3-bromophenyl)-2,5-dichlorothiophene-3-sulfonamide

C10H5Br2Cl2NO2S2 — CID 5092209

IUPAC4-bromo-N-(3-bromophenyl)-2,5-dichlorothiophene-3-sulfonamide
SMILESO=S(=O)(Nc1cccc(Br)c1)c1c(Cl)sc(Cl)c1Br
InChIInChI=1S/C10H5Br2Cl2NO2S2/c11-5-2-1-3-6(4-5)15-19(16,17)8-7(12)9(13)18-10(8)14/h1-4,15H
InChIKeyHJTPJQPBQHNENC-UHFFFAOYSA-N
MW466.00 g/mol
LogP5.38
Rot. Bonds3

About 4-bromo-N-(3-bromophenyl)-2,5-dichlorothiophene-3-sulfonamide

4-bromo-N-(3-bromophenyl)-2,5-dichlorothiophene-3-sulfonamide (PubChem CID 5092209) has the molecular formula C10H5Br2Cl2NO2S2 and a molecular weight of 466.00 g/mol. Its IUPAC name is 4-bromo-N-(3-bromophenyl)-2,5-dichlorothiophene-3-sulfonamide.

Molecular Properties

Compound Name4-bromo-N-(3-bromophenyl)-2,5-dichlorothiophene-3-sulfonamide
PubChem CID5092209
Molecular FormulaC10H5Br2Cl2NO2S2
Molecular Weight466.00 g/mol
Exact Mass462.75
IUPAC Name4-bromo-N-(3-bromophenyl)-2,5-dichlorothiophene-3-sulfonamide
SMILESO=S(=O)(Nc1cccc(Br)c1)c1c(Cl)sc(Cl)c1Br
InChIInChI=1S/C10H5Br2Cl2NO2S2/c11-5-2-1-3-6(4-5)15-19(16,17)8-7(12)9(13)18-10(8)14/h1-4,15H
InChIKeyHJTPJQPBQHNENC-UHFFFAOYSA-N
XLogP5.38
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500466.00
LogP ≤ 55.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1,3-benzodioxol-5-yl)-4-bromo-2,5-dichlorothiophene-3-sulfonamide
CID 3842403
4-amino-N-(3-bromophenyl)-2,6-dichlorobenzenesulfonamide
CID 43257573
4-bromo-2,5-dichloro-N-(3,5-dimethoxyphenyl)thiophene-3-sulfonamide
CID 3777525
4-bromo-2,5-dichloro-N-[3-(6-chloro-3,4-dihydroisoquinolin-1-yl)phenyl]thiophene-3-sulfonamide
CID 22640606
4-bromo-2,5-dichloro-N-[3-(6-fluoro-3,4-dihydroisoquinolin-1-yl)phenyl]thiophene-3-sulfonamide
CID 22640431
3-bromo-N-[(3-bromophenyl)sulfamoyl]aniline
CID 132513071
4-bromo-2,5-dichloro-N-(2-fluoro-4-iodophenyl)thiophene-3-sulfonamide
CID 3804697
N-(3-bromophenyl)-2,6-dimethyl-4-(methylamino)benzenesulfonamide
CID 107328569
2-amino-N-(3-bromophenyl)-6-methylbenzenesulfonamide
CID 43452387
4-bromo-2,5-dichloro-N-[5-(hydroxymethyl)-2-methylphenyl]thiophene-3-sulfonamide
CID 3377394
1-bromo-3-(sulfamoylamino)benzene
CID 24707479
N-(3-bromophenyl)-3,5-difluorobenzenesulfonamide
CID 26951692

Frequently Asked Questions

What is the IUPAC name of 4-bromo-N-(3-bromophenyl)-2,5-dichlorothiophene-3-sulfonamide?
The IUPAC name of 4-bromo-N-(3-bromophenyl)-2,5-dichlorothiophene-3-sulfonamide (CID 5092209) is 4-bromo-N-(3-bromophenyl)-2,5-dichlorothiophene-3-sulfonamide.
What is the SMILES notation for 4-bromo-N-(3-bromophenyl)-2,5-dichlorothiophene-3-sulfonamide?
The canonical SMILES for 4-bromo-N-(3-bromophenyl)-2,5-dichlorothiophene-3-sulfonamide is O=S(=O)(Nc1cccc(Br)c1)c1c(Cl)sc(Cl)c1Br.
What is the InChIKey of 4-bromo-N-(3-bromophenyl)-2,5-dichlorothiophene-3-sulfonamide?
The InChIKey is HJTPJQPBQHNENC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H5Br2Cl2NO2S2/c11-5-2-1-3-6(4-5)15-19(16,17)8-7(12)9(13)18-10(8)14/h1-4,15H.
What are the key properties of 4-bromo-N-(3-bromophenyl)-2,5-dichlorothiophene-3-sulfonamide?
4-bromo-N-(3-bromophenyl)-2,5-dichlorothiophene-3-sulfonamide has a molecular weight of 466.00 g/mol, XLogP of 5.38, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-N-(3-bromophenyl)-2,5-dichlorothiophene-3-sulfonamide is sourced from PubChem (CID 5092209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).