4,5-dibromo-N-(3-chlorophenyl)thiophene-2-sulfonamide

C10H6Br2ClNO2S2 — CID 3830186

IUPAC4,5-dibromo-N-(3-chlorophenyl)thiophene-2-sulfonamide
SMILESO=S(=O)(Nc1cccc(Cl)c1)c1cc(Br)c(Br)s1
InChIInChI=1S/C10H6Br2ClNO2S2/c11-8-5-9(17-10(8)12)18(15,16)14-7-3-1-2-6(13)4-7/h1-5,14H
InChIKeyCLLBKBQPXSTLQU-UHFFFAOYSA-N
MW431.56 g/mol
LogP4.73
Rot. Bonds3

About 4,5-dibromo-N-(3-chlorophenyl)thiophene-2-sulfonamide

4,5-dibromo-N-(3-chlorophenyl)thiophene-2-sulfonamide (PubChem CID 3830186) has the molecular formula C10H6Br2ClNO2S2 and a molecular weight of 431.56 g/mol. Its IUPAC name is 4,5-dibromo-N-(3-chlorophenyl)thiophene-2-sulfonamide.

Molecular Properties

Compound Name4,5-dibromo-N-(3-chlorophenyl)thiophene-2-sulfonamide
PubChem CID3830186
Molecular FormulaC10H6Br2ClNO2S2
Molecular Weight431.56 g/mol
Exact Mass428.79
IUPAC Name4,5-dibromo-N-(3-chlorophenyl)thiophene-2-sulfonamide
SMILESO=S(=O)(Nc1cccc(Cl)c1)c1cc(Br)c(Br)s1
InChIInChI=1S/C10H6Br2ClNO2S2/c11-8-5-9(17-10(8)12)18(15,16)14-7-3-1-2-6(13)4-7/h1-5,14H
InChIKeyCLLBKBQPXSTLQU-UHFFFAOYSA-N
XLogP4.73
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500431.56
LogP ≤ 54.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-bromo-N-[4-[(3-chlorophenyl)sulfamoyl]phenyl]thiophene-2-sulfonamide
CID 126134587
5-bromo-N-(4-bromo-3-chlorophenyl)-4-methylthiophene-2-sulfonamide
CID 107612767
5-bromo-N-(3,5-dichlorophenyl)-4-methylthiophene-2-sulfonamide
CID 79995879
5-bromo-4-methyl-N-(3-sulfamoylphenyl)thiophene-2-sulfonamide
CID 79912739
5-bromo-4-chloro-N-(3-methylsulfanylphenyl)thiophene-2-sulfonamide
CID 80578749
N-[3-(aminomethyl)phenyl]-5-bromo-4-chlorothiophene-2-sulfonamide
CID 80577855
4,5-dibromo-N-(4-chloro-1,3-benzothiazol-2-yl)thiophene-2-sulfonamide
CID 25042715
5-bromo-4-chloro-N-[3-[(dimethylamino)methyl]phenyl]thiophene-2-sulfonamide
CID 80578453
5-bromo-4-chloro-N-(3-ethoxyphenyl)thiophene-2-sulfonamide
CID 80578716
5-bromo-4-chloro-N-[3-[(Z)-N-hydroxy-C-methylcarbonimidoyl]phenyl]thiophene-2-sulfonamide
CID 80577321
N-(4-bromo-3-chlorophenyl)-5-chloro-4-nitrothiophene-2-sulfonamide
CID 107612754
N-(4-bromo-3-chlorophenyl)thiophene-2-sulfonamide
CID 2207523

Frequently Asked Questions

What is the IUPAC name of 4,5-dibromo-N-(3-chlorophenyl)thiophene-2-sulfonamide?
The IUPAC name of 4,5-dibromo-N-(3-chlorophenyl)thiophene-2-sulfonamide (CID 3830186) is 4,5-dibromo-N-(3-chlorophenyl)thiophene-2-sulfonamide.
What is the SMILES notation for 4,5-dibromo-N-(3-chlorophenyl)thiophene-2-sulfonamide?
The canonical SMILES for 4,5-dibromo-N-(3-chlorophenyl)thiophene-2-sulfonamide is O=S(=O)(Nc1cccc(Cl)c1)c1cc(Br)c(Br)s1.
What is the InChIKey of 4,5-dibromo-N-(3-chlorophenyl)thiophene-2-sulfonamide?
The InChIKey is CLLBKBQPXSTLQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6Br2ClNO2S2/c11-8-5-9(17-10(8)12)18(15,16)14-7-3-1-2-6(13)4-7/h1-5,14H.
What are the key properties of 4,5-dibromo-N-(3-chlorophenyl)thiophene-2-sulfonamide?
4,5-dibromo-N-(3-chlorophenyl)thiophene-2-sulfonamide has a molecular weight of 431.56 g/mol, XLogP of 4.73, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-dibromo-N-(3-chlorophenyl)thiophene-2-sulfonamide is sourced from PubChem (CID 3830186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).