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Home > Indoles and Oxindole > 22958-05-0
22958-05-0 | Methanone, 1H-indol-1-yl(4-nitrophenyl)-
CAS No: 22958-05-0 Catalog No: AG002LNV MDL No:
Product Description
Catalog Number:
AG002LNV
Chemical Name:
Methanone, 1H-indol-1-yl(4-nitrophenyl)-
CAS Number:
22958-05-0
Molecular Formula:
C15H10N2O3
Molecular Weight:
266.2515
IUPAC Name:
indol-1-yl-(4-nitrophenyl)methanone
InChI:
InChI=1S/C15H10N2O3/c18-15(12-5-7-13(8-6-12)17(19)20)16-10-9-11-3-1-2-4-14(11)16/h1-10H
InChI Key:
DGDZMLHVARJZHR-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(cc1)C(=O)n1ccc2c1cccc2
Properties
Complexity:
385
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.069g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
266.256g/mol
Monoisotopic Mass:
266.069g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
67.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
Literature
| Title | Journal |
|---|---|
| Novel heteroaromatic organofluorine inhibitors of fructose-1,6-bisphosphatase. | Journal of medicinal chemistry 20090212 |
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