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Home > Imidazoles > 127296-23-5
127296-23-5 | 1H-Pyrazole, 1-(1-methyl-4-nitro-1H-imidazol-5-yl)-
CAS No: 127296-23-5 Catalog No: AG000WWA MDL No:
Product Description
Catalog Number:
AG000WWA
Chemical Name:
1H-Pyrazole, 1-(1-methyl-4-nitro-1H-imidazol-5-yl)-
CAS Number:
127296-23-5
Molecular Formula:
C7H7N5O2
Molecular Weight:
193.1628
IUPAC Name:
1-methyl-4-nitro-5-pyrazol-1-ylimidazole
InChI:
InChI=1S/C7H7N5O2/c1-10-5-8-6(12(13)14)7(10)11-4-2-3-9-11/h2-5H,1H3
InChI Key:
RURLSWSURUCZBT-UHFFFAOYSA-N
SMILES:
Cn1cnc(c1n1cccn1)[N+](=O)[O-]
Properties
Complexity:
231
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.06g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
193.166g/mol
Monoisotopic Mass:
193.06g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
81.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
Literature
| Title | Journal |
|---|---|
| Novel nitroimidazoles with trypanocidal and cell growth inhibition activities. | Cytobios 20010101 |
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