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263015-77-6

263015-77-6 | 4-Thiazolecarboxylic acid, 2-[[(4-chlorophenyl)sulfonyl]methyl]-, hydrazide

CAS No: 263015-77-6 Catalog No: AG002SMF MDL No:MFCD00179394

Product Description

Catalog Number:
AG002SMF
Chemical Name:
4-Thiazolecarboxylic acid, 2-[[(4-chlorophenyl)sulfonyl]methyl]-, hydrazide
CAS Number:
263015-77-6
Molecular Formula:
C11H10ClN3O3S2
Molecular Weight:
331.7984
MDL Number:
MFCD00179394
IUPAC Name:
2-[(4-chlorophenyl)sulfonylmethyl]-1,3-thiazole-4-carbohydrazide
InChI:
InChI=1S/C11H10ClN3O3S2/c12-7-1-3-8(4-2-7)20(17,18)6-10-14-9(5-19-10)11(16)15-13/h1-5H,6,13H2,(H,15,16)
InChI Key:
LHFIQOGDBKJPTK-UHFFFAOYSA-N
SMILES:
NNC(=O)c1csc(n1)CS(=O)(=O)c1ccc(cc1)Cl

Properties

Complexity:
446  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
330.985g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
331.789g/mol
Monoisotopic Mass:
330.985g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
139A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  

Literature

Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
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

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