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N-(1-Methyl-1H-benzimidazol-2-yl)-benzenesulfonamide

HCID 391368
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Basic information

CAS
173374-93-1
Standard SMILES
Cn1c(NS(=O)(=O)c2ccccc2)nc2ccccc21
InChIKey
ZAWUKQCLEWGNRF-UHFFFAOYSA-N
Molecular formula
C14H13N3O2S
Average molar mass
287.34 g/mol
Monoisotopic mass
287.07284784

Names & identifiers

Preferred name
N-(1-Methyl-1H-benzimidazol-2-yl)-benzenesulfonamide
IUPAC
N-(1-methylbenzimidazol-2-yl)benzenesulfonamide

Names & synonyms

173374-93-1N-(1-Methyl-1H-benzimidazol-2-yl)-benzenesulfonamideNSC690403N-(1-Methyl-1H-benzimidazol-2-yl)benzenesulfonamideN-(1-methylbenzimidazol-2-yl)benzenesulfonamideSCHEMBL977464CHEMBL1981605DTXSID20169608ZAWUKQCLEWGNRF-UHFFFAOYSA-NNSC-690403NCI60_032463DB-417745
Show more names
BRD-K58966845-001-01-5N-(1-Methyl-1H-1,3-benzimidazol-2-yl)benzenesulfonamide

Database identifiers

CAS
173374-93-1
PubChem CID
391368
DTXSID
DTXSID20169608
ChEMBL
CHEMBL1981605
Nikkaji
J861.511J

Properties

Computed structural properties

XLogP
2.3
Topological polar surface area
72.4 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
3
Heavy atoms
20
Formal charge
0
Complexity
428

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Related reactions

4 records
New reaction record
HRID 875178 reaction equation
HRID 875178As reactantuspto-grants-2015_03
HRID 885450 reaction equation
HRID 885450As reactantuspto-grants-2012_08
HRID 2098355 reaction equation
HRID 2098355As reactantuspto-grants-2013_05
HRID 2317413 reaction equation
HRID 2317413As reactantTraining data from https://doi.org/10.1039/C8SC04228D (10/10)

Compound notes

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