N-(benzimidazol-1-yl)benzenesulfonamide

C13H11N3O2S — CID 118414889

IUPACN-(benzimidazol-1-yl)benzenesulfonamide
SMILESO=S(=O)(Nn1cnc2ccccc21)c1ccccc1
InChIInChI=1S/C13H11N3O2S/c17-19(18,11-6-2-1-3-7-11)15-16-10-14-12-8-4-5-9-13(12)16/h1-10,15H
InChIKeyJBUBTSNREPBZMU-UHFFFAOYSA-N
MW273.32 g/mol
LogP1.97
Rot. Bonds3

About N-(benzimidazol-1-yl)benzenesulfonamide

N-(benzimidazol-1-yl)benzenesulfonamide (PubChem CID 118414889) has the molecular formula C13H11N3O2S and a molecular weight of 273.32 g/mol. Its IUPAC name is N-(benzimidazol-1-yl)benzenesulfonamide.

Molecular Properties

Compound NameN-(benzimidazol-1-yl)benzenesulfonamide
PubChem CID118414889
Molecular FormulaC13H11N3O2S
Molecular Weight273.32 g/mol
Exact Mass273.06
IUPAC NameN-(benzimidazol-1-yl)benzenesulfonamide
SMILESO=S(=O)(Nn1cnc2ccccc21)c1ccccc1
InChIInChI=1S/C13H11N3O2S/c17-19(18,11-6-2-1-3-7-11)15-16-10-14-12-8-4-5-9-13(12)16/h1-10,15H
InChIKeyJBUBTSNREPBZMU-UHFFFAOYSA-N
XLogP1.97
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.32
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

benzimidazol-1-ylcarbamic acid
CID 21218422
N-(benzimidazol-1-yl)acetamide
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N-[[4-(benzimidazol-1-yl)phenyl]methyl]benzenesulfonamide
CID 166203692
N-[4-[2-(benzimidazol-1-yl)ethyl]phenyl]benzenesulfonamide
CID 171418978
2-(benzimidazol-1-ylcarbamoyl)benzoic acid
CID 134107318
N-(benzimidazol-1-yl)-3-phenylsulfanylpropanamide
CID 34327055
N-(benzimidazol-1-yl)-2-methylsulfonylbenzamide
CID 34338436
N-(benzimidazol-1-yl)-3-oxobutanamide
CID 87961400
N-(benzimidazol-1-yl)-3-(cyclopropylsulfamoyl)benzamide
CID 17473290
N-(benzimidazol-1-yl)-2,4-dichloro-5-sulfamoylbenzamide
CID 138377179
N-(benzimidazol-1-yl)-2-bromobenzamide
CID 24535711
N-pyrrol-1-ylbenzenesulfonamide
CID 118078306

Frequently Asked Questions

What is the IUPAC name of N-(benzimidazol-1-yl)benzenesulfonamide?
The IUPAC name of N-(benzimidazol-1-yl)benzenesulfonamide (CID 118414889) is N-(benzimidazol-1-yl)benzenesulfonamide.
What is the SMILES notation for N-(benzimidazol-1-yl)benzenesulfonamide?
The canonical SMILES for N-(benzimidazol-1-yl)benzenesulfonamide is O=S(=O)(Nn1cnc2ccccc21)c1ccccc1.
What is the InChIKey of N-(benzimidazol-1-yl)benzenesulfonamide?
The InChIKey is JBUBTSNREPBZMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11N3O2S/c17-19(18,11-6-2-1-3-7-11)15-16-10-14-12-8-4-5-9-13(12)16/h1-10,15H.
What are the key properties of N-(benzimidazol-1-yl)benzenesulfonamide?
N-(benzimidazol-1-yl)benzenesulfonamide has a molecular weight of 273.32 g/mol, XLogP of 1.97, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(benzimidazol-1-yl)benzenesulfonamide is sourced from PubChem (CID 118414889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).