4-[1-(4-chlorophenyl)benzimidazol-2-yl]benzenesulfonamide

C19H14ClN3O2S — CID 11625155

IUPAC4-[1-(4-chlorophenyl)benzimidazol-2-yl]benzenesulfonamide
SMILESNS(=O)(=O)c1ccc(-c2nc3ccccc3n2-c2ccc(Cl)cc2)cc1
InChIInChI=1S/C19H14ClN3O2S/c20-14-7-9-15(10-8-14)23-18-4-2-1-3-17(18)22-19(23)13-5-11-16(12-6-13)26(21,24)25/h1-12H,(H2,21,24,25)
InChIKeyCMEXTGCHGVNYOB-UHFFFAOYSA-N
MW383.86 g/mol
LogP3.99
Rot. Bonds3

About 4-[1-(4-chlorophenyl)benzimidazol-2-yl]benzenesulfonamide

4-[1-(4-chlorophenyl)benzimidazol-2-yl]benzenesulfonamide (PubChem CID 11625155) has the molecular formula C19H14ClN3O2S and a molecular weight of 383.86 g/mol. Its IUPAC name is 4-[1-(4-chlorophenyl)benzimidazol-2-yl]benzenesulfonamide.

Molecular Properties

Compound Name4-[1-(4-chlorophenyl)benzimidazol-2-yl]benzenesulfonamide
PubChem CID11625155
Molecular FormulaC19H14ClN3O2S
Molecular Weight383.86 g/mol
Exact Mass383.05
IUPAC Name4-[1-(4-chlorophenyl)benzimidazol-2-yl]benzenesulfonamide
SMILESNS(=O)(=O)c1ccc(-c2nc3ccccc3n2-c2ccc(Cl)cc2)cc1
InChIInChI=1S/C19H14ClN3O2S/c20-14-7-9-15(10-8-14)23-18-4-2-1-3-17(18)22-19(23)13-5-11-16(12-6-13)26(21,24)25/h1-12H,(H2,21,24,25)
InChIKeyCMEXTGCHGVNYOB-UHFFFAOYSA-N
XLogP3.99
TPSA77.98 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.86
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[1-(4-chlorophenyl)benzimidazol-2-yl]benzenesulfonamide?
The IUPAC name of 4-[1-(4-chlorophenyl)benzimidazol-2-yl]benzenesulfonamide (CID 11625155) is 4-[1-(4-chlorophenyl)benzimidazol-2-yl]benzenesulfonamide.
What is the SMILES notation for 4-[1-(4-chlorophenyl)benzimidazol-2-yl]benzenesulfonamide?
The canonical SMILES for 4-[1-(4-chlorophenyl)benzimidazol-2-yl]benzenesulfonamide is NS(=O)(=O)c1ccc(-c2nc3ccccc3n2-c2ccc(Cl)cc2)cc1.
What is the InChIKey of 4-[1-(4-chlorophenyl)benzimidazol-2-yl]benzenesulfonamide?
The InChIKey is CMEXTGCHGVNYOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14ClN3O2S/c20-14-7-9-15(10-8-14)23-18-4-2-1-3-17(18)22-19(23)13-5-11-16(12-6-13)26(21,24)25/h1-12H,(H2,21,24,25).
What are the key properties of 4-[1-(4-chlorophenyl)benzimidazol-2-yl]benzenesulfonamide?
4-[1-(4-chlorophenyl)benzimidazol-2-yl]benzenesulfonamide has a molecular weight of 383.86 g/mol, XLogP of 3.99, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-(4-chlorophenyl)benzimidazol-2-yl]benzenesulfonamide is sourced from PubChem (CID 11625155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).