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Home Sulfos 1-[4-(Aminosulfonyl)phenyl]-5-(4-chlorophenyl)-1h-pyrazole-3-carboxylic acid

1-[4-(Aminosulfonyl)phenyl]-5-(4-chlorophenyl)-1h-pyrazole-3-carboxylic acid

CAS No.:
170571-19-4
Catalog Number:
AG00HZEG
Molecular Formula:
C16H12ClN3O4S
Molecular Weight:
377.8022
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
In Stock USA
United States
$706
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Product Description
Catalog Number:
AG00HZEG
Chemical Name:
1-[4-(Aminosulfonyl)phenyl]-5-(4-chlorophenyl)-1h-pyrazole-3-carboxylic acid
CAS Number:
170571-19-4
Molecular Formula:
C16H12ClN3O4S
Molecular Weight:
377.8022
MDL Number:
MFCD01316456
IUPAC Name:
5-(4-chlorophenyl)-1-(4-sulfamoylphenyl)pyrazole-3-carboxylic acid
InChI:
InChI=1S/C16H12ClN3O4S/c17-11-3-1-10(2-4-11)15-9-14(16(21)22)19-20(15)12-5-7-13(8-6-12)25(18,23)24/h1-9H,(H,21,22)(H2,18,23,24)
InChI Key:
NHAUQESLCOSREJ-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)c1cc(nn1c1ccc(cc1)S(=O)(=O)N)C(=O)O
Properties
Complexity:
581  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
377.024g/mol
Formal Charge:
0
Heavy Atom Count:
25  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
377.799g/mol
Monoisotopic Mass:
377.024g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
124A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Literature
Title Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties