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Home > Sulfanilamide > 693805-48-0
693805-48-0 | 2,5-dimethoxy-N-methylbenzene-1-sulfonamide
CAS No: 693805-48-0 Catalog No: AG01EIEF MDL No:MFCD03997621
Product Description
Catalog Number:
AG01EIEF
Chemical Name:
2,5-dimethoxy-N-methylbenzene-1-sulfonamide
CAS Number:
693805-48-0
Molecular Formula:
C9H13NO4S
Molecular Weight:
231.2688
MDL Number:
MFCD03997621
IUPAC Name:
2,5-dimethoxy-N-methylbenzenesulfonamide
InChI:
InChI=1S/C9H13NO4S/c1-10-15(11,12)9-6-7(13-2)4-5-8(9)14-3/h4-6,10H,1-3H3
InChI Key:
DBFYCPPMAVPSBV-UHFFFAOYSA-N
SMILES:
COc1ccc(c(c1)S(=O)(=O)NC)OC
Properties
Complexity:
285
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.057g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
231.266g/mol
Monoisotopic Mass:
231.057g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
73A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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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