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Home Sulfos 4-[2-(Dimethylamino)ethylaminosulfonyl]-7-chloro-2,1,3-benzoxadiazole

4-[2-(Dimethylamino)ethylaminosulfonyl]-7-chloro-2,1,3-benzoxadiazole

CAS No.:
664985-43-7
Catalog Number:
AG00FD03
Molecular Formula:
C10H13ClN4O3S
Molecular Weight:
304.7532
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Product Description
Catalog Number:
AG00FD03
Chemical Name:
4-[2-(Dimethylamino)ethylaminosulfonyl]-7-chloro-2,1,3-benzoxadiazole
CAS Number:
664985-43-7
Molecular Formula:
C10H13ClN4O3S
Molecular Weight:
304.7532
MDL Number:
MFCD08276273
IUPAC Name:
4-chloro-N-[2-(dimethylamino)ethyl]-2,1,3-benzoxadiazole-7-sulfonamide
InChI:
InChI=1S/C10H13ClN4O3S/c1-15(2)6-5-12-19(16,17)8-4-3-7(11)9-10(8)14-18-13-9/h3-4,12H,5-6H2,1-2H3
InChI Key:
RJEYFWVHUXSWTA-UHFFFAOYSA-N
SMILES:
CN(CCNS(=O)(=O)c1ccc(c2c1non2)Cl)C
Properties
Complexity:
400  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
304.04g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
304.749g/mol
Monoisotopic Mass:
304.04g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
96.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
Literature
Title Journal
FD-LC-MS/MS method for determining protein expression and elucidating biochemical events in tissues and cells. Biological & pharmaceutical bulletin 20120101
Liquid chromatographic separation of proteins derivatized with a fluorogenic reagent at cysteinyl residues on a non-porous column for differential proteomics analysis. Journal of chromatography. A 20110603
Synthesis and evaluation of a fluorogenic reagent for proteomic studies: 7-fluoro-N-[2-(dimethylamino)ethyl]-2,1,3-benzoxadiazole-4-sulfonamide (DAABD-F). The Analyst 20100801
Existence of low-molecular-weight thiols in Caenorhabditis elegans demonstrated by HPLC-fluorescene detection utilizing 7-chloro-N-[2-(dimethylamino)ethyl]-2,1,3-benzoxadiazole-4-sulfonamide. Biomedical chromatography : BMC 20071001
An improved method for proteomics studies in C. elegans by fluorogenic derivatization, HPLC isolation, enzymatic digestion and liquid chromatography--tandem mass spectrometric identification. Biomedical chromatography : BMC 20050901
Fluorogenic derivatization reagents suitable for isolation and identification of cysteine-containing proteins utilizing high-performance liquid chromatography-tandem mass spectrometry. Analytical chemistry 20040201
Properties