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Home > Sulfanilamide > 875163-22-7
875163-22-7 | 1-ethyl-N,N-dimethyl-2,3-dioxo-1,2,3,4-tetrahydroquinoxaline-6-sulfonamide
CAS No: 875163-22-7 Catalog No: AG019P9Z MDL No:MFCD07838409
Product Description
Catalog Number:
AG019P9Z
Chemical Name:
1-ethyl-N,N-dimethyl-2,3-dioxo-1,2,3,4-tetrahydroquinoxaline-6-sulfonamide
CAS Number:
875163-22-7
Molecular Formula:
C12H15N3O4S
Molecular Weight:
297.3302
MDL Number:
MFCD07838409
IUPAC Name:
1-ethyl-N,N-dimethyl-2,3-dioxo-4H-quinoxaline-6-sulfonamide
InChI:
InChI=1S/C12H15N3O4S/c1-4-15-10-6-5-8(20(18,19)14(2)3)7-9(10)13-11(16)12(15)17/h5-7H,4H2,1-3H3,(H,13,16)
InChI Key:
WSNHHIVEQYNZIN-UHFFFAOYSA-N
SMILES:
CCn1c2ccc(cc2[nH]c(=O)c1=O)S(=O)(=O)N(C)C
Properties
Complexity:
511
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
297.078g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
297.329g/mol
Monoisotopic Mass:
297.078g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
95.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
Literature
| Title | Journal |
|---|---|
| Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. | Bioorganic & medicinal chemistry letters 20101101 |
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