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Home Sulfos Benzenesulfonamide, 4-[[(methylamino)carbonyl]amino]-

Benzenesulfonamide, 4-[[(methylamino)carbonyl]amino]-

CAS No.:
129513-93-5
Catalog Number:
AG0072NR
Molecular Formula:
C8H11N3O3S
Molecular Weight:
229.2562
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Product Description
Catalog Number:
AG0072NR
Chemical Name:
Benzenesulfonamide, 4-[[(methylamino)carbonyl]amino]-
CAS Number:
129513-93-5
Molecular Formula:
C8H11N3O3S
Molecular Weight:
229.2562
MDL Number:
MFCD00031440
IUPAC Name:
1-methyl-3-(4-sulfamoylphenyl)urea
InChI:
InChI=1S/C8H11N3O3S/c1-10-8(12)11-6-2-4-7(5-3-6)15(9,13)14/h2-5H,1H3,(H2,9,13,14)(H2,10,11,12)
InChI Key:
CNNRTLYSXSQFBO-UHFFFAOYSA-N
SMILES:
CNC(=O)Nc1ccc(cc1)S(=O)(=O)N
NSC Number:
133195
Properties
Complexity:
315  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.052g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
229.254g/mol
Monoisotopic Mass:
229.052g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
110A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2  
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