CAS 51891-85-1 | 4-(1H-PYRAZOL-1-YL)BENZENE-1-SULFONAMIDE | CAS Number 51891-85-1

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51891-85-1 | 4-(1H-PYRAZOL-1-YL)BENZENE-1-SULFONAMIDE

CAS No: 51891-85-1 Catalog No: AG00DIW5 MDL No:MFCD11504936

Product Description

Catalog Number:

AG00DIW5

Chemical Name:

4-(1H-PYRAZOL-1-YL)BENZENE-1-SULFONAMIDE

CAS Number:

51891-85-1

Molecular Formula:

C9H9N3O2S

Molecular Weight:

223.2517

MDL Number:

MFCD11504936

IUPAC Name:

4-pyrazol-1-ylbenzenesulfonamide

InChI:

InChI=1S/C9H9N3O2S/c10-15(13,14)9-4-2-8(3-5-9)12-7-1-6-11-12/h1-7H,(H2,10,13,14)

InChI Key:

UJLPVGLFJFFLCR-UHFFFAOYSA-N

SMILES:

NS(=O)(=O)c1ccc(cc1)n1cccn1

Properties

Complexity:

304

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

223.042g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

223.25g/mol

Monoisotopic Mass:

223.042g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

86.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.8

Literature

Title	Journal
4-(1H-Pyrazol-1-yl) benzenesulfonamide derivatives: identifying new active antileishmanial structures for use against a neglected disease.	Molecules (Basel, Switzerland) 20121101
Synthesis and biological evaluation of novel pyrazole derivatives as anti-inflammatory antimicrobial agents.	Medicinal chemistry (Shariqah (United Arab Emirates)) 20090301