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

C15H10Cl3N3O2S — CID 3859357

IUPAC2-chloro-N-[4-(4,5-dichloroimidazol-1-yl)phenyl]benzenesulfonamide
SMILESO=S(=O)(Nc1ccc(-n2cnc(Cl)c2Cl)cc1)c1ccccc1Cl
InChIInChI=1S/C15H10Cl3N3O2S/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
InChIKeyZBXMHDIXXYUTLL-UHFFFAOYSA-N
MW402.69 g/mol
LogP4.63
Rot. Bonds4

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

2-chloro-N-[4-(4,5-dichloroimidazol-1-yl)phenyl]benzenesulfonamide (PubChem CID 3859357) has the molecular formula C15H10Cl3N3O2S and a molecular weight of 402.69 g/mol. Its IUPAC name is 2-chloro-N-[4-(4,5-dichloroimidazol-1-yl)phenyl]benzenesulfonamide.

Molecular Properties

Compound Name2-chloro-N-[4-(4,5-dichloroimidazol-1-yl)phenyl]benzenesulfonamide
PubChem CID3859357
Molecular FormulaC15H10Cl3N3O2S
Molecular Weight402.69 g/mol
Exact Mass400.96
IUPAC Name2-chloro-N-[4-(4,5-dichloroimidazol-1-yl)phenyl]benzenesulfonamide
SMILESO=S(=O)(Nc1ccc(-n2cnc(Cl)c2Cl)cc1)c1ccccc1Cl
InChIInChI=1S/C15H10Cl3N3O2S/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
InChIKeyZBXMHDIXXYUTLL-UHFFFAOYSA-N
XLogP4.63
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500402.69
LogP ≤ 54.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-bromo-N-[4-(4,5-dichloroimidazol-1-yl)phenyl]benzenesulfonamide
CID 3276095
2,4-dichloro-N-[4-(4,5-dichloroimidazol-1-yl)phenyl]benzenesulfonamide
CID 3851178
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
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
N-[4-(4-acetylpiperazin-1-yl)phenyl]-2-chlorobenzenesulfonamide
CID 110369728
2-chloro-N-(4-phenoxyphenyl)benzenesulfonamide
CID 113098760
2-chloro-N-[4-(2-chloroethyl)phenyl]benzenesulfonamide
CID 65031108
2-chloro-N-(2-pyrrolidin-1-ylpyrimidin-5-yl)benzenesulfonamide
CID 71790187
2-chloro-N-(4-phenylmethoxyphenyl)benzenesulfonamide
CID 45369229
2-[4-[(2-chlorophenyl)sulfonylamino]phenyl]acetate
CID 7042231

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[4-(4,5-dichloroimidazol-1-yl)phenyl]benzenesulfonamide?
The IUPAC name of 2-chloro-N-[4-(4,5-dichloroimidazol-1-yl)phenyl]benzenesulfonamide (CID 3859357) is 2-chloro-N-[4-(4,5-dichloroimidazol-1-yl)phenyl]benzenesulfonamide.
What is the SMILES notation for 2-chloro-N-[4-(4,5-dichloroimidazol-1-yl)phenyl]benzenesulfonamide?
The canonical SMILES for 2-chloro-N-[4-(4,5-dichloroimidazol-1-yl)phenyl]benzenesulfonamide is O=S(=O)(Nc1ccc(-n2cnc(Cl)c2Cl)cc1)c1ccccc1Cl.
What is the InChIKey of 2-chloro-N-[4-(4,5-dichloroimidazol-1-yl)phenyl]benzenesulfonamide?
The InChIKey is ZBXMHDIXXYUTLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10Cl3N3O2S/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-chloro-N-[4-(4,5-dichloroimidazol-1-yl)phenyl]benzenesulfonamide?
2-chloro-N-[4-(4,5-dichloroimidazol-1-yl)phenyl]benzenesulfonamide has a molecular weight of 402.69 g/mol, XLogP of 4.63, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[4-(4,5-dichloroimidazol-1-yl)phenyl]benzenesulfonamide is sourced from PubChem (CID 3859357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).