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Home Sulfos Benzenesulfonamide,3,4-diethoxy-

Benzenesulfonamide,3,4-diethoxy-

CAS No.:
104296-87-9
Catalog Number:
AG00864A
Molecular Formula:
C10H15NO4S
Molecular Weight:
245.2954
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Product Description
Catalog Number:
AG00864A
Chemical Name:
Benzenesulfonamide,3,4-diethoxy-
CAS Number:
104296-87-9
Molecular Formula:
C10H15NO4S
Molecular Weight:
245.2954
MDL Number:
MFCD07325239
IUPAC Name:
3,4-diethoxybenzenesulfonamide
InChI:
InChI=1S/C10H15NO4S/c1-3-14-9-6-5-8(16(11,12)13)7-10(9)15-4-2/h5-7H,3-4H2,1-2H3,(H2,11,12,13)
InChI Key:
SRYAXGQHQSSIHQ-UHFFFAOYSA-N
SMILES:
CCOc1cc(ccc1OCC)S(=O)(=O)N
Properties
Complexity:
298  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.072g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
245.293g/mol
Monoisotopic Mass:
245.072g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
87A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Properties