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Home > Nitro Compounds > 29699-89-6
29699-89-6 | Benzenesulfonamide, N-(5-methyl-3-isoxazolyl)-4-nitro-
CAS No: 29699-89-6 Catalog No: AG002Z4I MDL No:
Product Description
Catalog Number:
AG002Z4I
Chemical Name:
Benzenesulfonamide, N-(5-methyl-3-isoxazolyl)-4-nitro-
CAS Number:
29699-89-6
Molecular Formula:
C10H9N3O5S
Molecular Weight:
283.2606
IUPAC Name:
N-(5-methyl-1,2-oxazol-3-yl)-4-nitrobenzenesulfonamide
InChI:
InChI=1S/C10H9N3O5S/c1-7-6-10(11-18-7)12-19(16,17)9-4-2-8(3-5-9)13(14)15/h2-6H,1H3,(H,11,12)
InChI Key:
XHJLDAHBWWMCRZ-UHFFFAOYSA-N
SMILES:
Cc1onc(c1)NS(=O)(=O)c1ccc(cc1)[N+](=O)[O-]
Properties
Complexity:
421
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.026g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
283.258g/mol
Monoisotopic Mass:
283.026g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
126A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
Literature
| Title | Journal |
|---|---|
| Evidence for the microbially mediated abiotic formation of reversible and non-reversible sulfamethoxazole transformation products during denitrification. | Water research 20120501 |
| In vivo and in vitro anti-leishmanial activities of 4-nitro-N-pyrimidin- and N-pyrazin-2-ylbenzenesulfonamides, and N2-(4-nitrophenyl)-N1-propylglycinamide. | Bioorganic & medicinal chemistry 20091101 |
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