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Home > Nitro Compounds > 779327-09-2
779327-09-2 | 2-Furancarboxamide, 5-nitro-N-[3-(phenylmethoxy)phenyl]-
CAS No: 779327-09-2 Catalog No: AG005QMJ MDL No:
Product Description
Catalog Number:
AG005QMJ
Chemical Name:
2-Furancarboxamide, 5-nitro-N-[3-(phenylmethoxy)phenyl]-
CAS Number:
779327-09-2
Molecular Formula:
C18H14N2O5
Molecular Weight:
338.3142
IUPAC Name:
5-nitro-N-(3-phenylmethoxyphenyl)furan-2-carboxamide
InChI:
InChI=1S/C18H14N2O5/c21-18(16-9-10-17(25-16)20(22)23)19-14-7-4-8-15(11-14)24-12-13-5-2-1-3-6-13/h1-11H,12H2,(H,19,21)
InChI Key:
RCNJNHDNXGLKNZ-UHFFFAOYSA-N
SMILES:
O=C(c1ccc(o1)[N+](=O)[O-])Nc1cccc(c1)OCc1ccccc1
Properties
Complexity:
461
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
338.09g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
338.319g/mol
Monoisotopic Mass:
338.09g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
97.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
Literature
| Title | Journal |
|---|---|
| Synthesis and evaluation of nitrofuranylamides as novel antituberculosis agents. | Journal of medicinal chemistry 20041007 |
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