2-bromo-N-[4-(4,5-dichloroimidazol-1-yl)phenyl]benzenesulfonamide

C15H10BrCl2N3O2S — CID 3276095

IUPAC2-bromo-N-[4-(4,5-dichloroimidazol-1-yl)phenyl]benzenesulfonamide
SMILESO=S(=O)(Nc1ccc(-n2cnc(Cl)c2Cl)cc1)c1ccccc1Br
InChIInChI=1S/C15H10BrCl2N3O2S/c16-12-3-1-2-4-13(12)24(22,23)20-10-5-7-11(8-6-10)21-9-19-14(17)15(21)18/h1-9,20H
InChIKeyQEPJNIQQMUEQEX-UHFFFAOYSA-N
MW447.14 g/mol
LogP4.74
Rot. Bonds4

About 2-bromo-N-[4-(4,5-dichloroimidazol-1-yl)phenyl]benzenesulfonamide

2-bromo-N-[4-(4,5-dichloroimidazol-1-yl)phenyl]benzenesulfonamide (PubChem CID 3276095) has the molecular formula C15H10BrCl2N3O2S and a molecular weight of 447.14 g/mol. Its IUPAC name is 2-bromo-N-[4-(4,5-dichloroimidazol-1-yl)phenyl]benzenesulfonamide.

Molecular Properties

Compound Name2-bromo-N-[4-(4,5-dichloroimidazol-1-yl)phenyl]benzenesulfonamide
PubChem CID3276095
Molecular FormulaC15H10BrCl2N3O2S
Molecular Weight447.14 g/mol
Exact Mass444.91
IUPAC Name2-bromo-N-[4-(4,5-dichloroimidazol-1-yl)phenyl]benzenesulfonamide
SMILESO=S(=O)(Nc1ccc(-n2cnc(Cl)c2Cl)cc1)c1ccccc1Br
InChIInChI=1S/C15H10BrCl2N3O2S/c16-12-3-1-2-4-13(12)24(22,23)20-10-5-7-11(8-6-10)21-9-19-14(17)15(21)18/h1-9,20H
InChIKeyQEPJNIQQMUEQEX-UHFFFAOYSA-N
XLogP4.74
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500447.14
LogP ≤ 54.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-bromo-N-[4-(4,5-dichloroimidazol-1-yl)phenyl]benzenesulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-chloro-N-[4-(4,5-dichloroimidazol-1-yl)phenyl]benzenesulfonamide
CID 3859357
N-[4-(4,5-dichloroimidazol-1-yl)phenyl]quinoline-8-sulfonamide
CID 3866993
N-[4-(4,5-dichloroimidazol-1-yl)phenyl]-4-iodobenzenesulfonamide
CID 3277746
2,4-dichloro-N-[4-(4,5-dichloroimidazol-1-yl)phenyl]benzenesulfonamide
CID 3851178
N-[4-(4,5-dichloroimidazol-1-yl)phenyl]pyridine-3-sulfonamide
CID 25036762
2-chloro-5-[[4-(4,5-dichloroimidazol-1-yl)phenyl]sulfamoyl]benzoic acid
CID 58937020
2-bromo-N-[4-(chloromethyl)phenyl]benzenesulfonamide
CID 65030964
2-bromo-N-(4-tert-butylphenyl)benzenesulfonamide
CID 3263186
2-bromo-N-(4-chloro-3-fluorophenyl)benzenesulfonamide
CID 47310409
2-bromo-N-[4-(2-bromoethyl)phenyl]benzenesulfonamide
CID 114296440
2-bromo-N-[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]benzenesulfonamide
CID 52781998
2-bromo-N-[4-[(6-pyrazol-1-ylpyrimidin-4-yl)amino]phenyl]benzenesulfonamide
CID 122290773

Frequently Asked Questions

What is the IUPAC name of 2-bromo-N-[4-(4,5-dichloroimidazol-1-yl)phenyl]benzenesulfonamide?
The IUPAC name of 2-bromo-N-[4-(4,5-dichloroimidazol-1-yl)phenyl]benzenesulfonamide (CID 3276095) is 2-bromo-N-[4-(4,5-dichloroimidazol-1-yl)phenyl]benzenesulfonamide.
What is the SMILES notation for 2-bromo-N-[4-(4,5-dichloroimidazol-1-yl)phenyl]benzenesulfonamide?
The canonical SMILES for 2-bromo-N-[4-(4,5-dichloroimidazol-1-yl)phenyl]benzenesulfonamide is O=S(=O)(Nc1ccc(-n2cnc(Cl)c2Cl)cc1)c1ccccc1Br.
What is the InChIKey of 2-bromo-N-[4-(4,5-dichloroimidazol-1-yl)phenyl]benzenesulfonamide?
The InChIKey is QEPJNIQQMUEQEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10BrCl2N3O2S/c16-12-3-1-2-4-13(12)24(22,23)20-10-5-7-11(8-6-10)21-9-19-14(17)15(21)18/h1-9,20H.
What are the key properties of 2-bromo-N-[4-(4,5-dichloroimidazol-1-yl)phenyl]benzenesulfonamide?
2-bromo-N-[4-(4,5-dichloroimidazol-1-yl)phenyl]benzenesulfonamide has a molecular weight of 447.14 g/mol, XLogP of 4.74, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-N-[4-(4,5-dichloroimidazol-1-yl)phenyl]benzenesulfonamide is sourced from PubChem (CID 3276095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).