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Home > Nitro Compounds > 831203-63-5
831203-63-5 | 2-Furancarboxamide, N-[3-(4-morpholinyl)phenyl]-5-nitro-
CAS No: 831203-63-5 Catalog No: AG004WCY MDL No:
Product Description
Catalog Number:
AG004WCY
Chemical Name:
2-Furancarboxamide, N-[3-(4-morpholinyl)phenyl]-5-nitro-
CAS Number:
831203-63-5
Molecular Formula:
C15H15N3O5
Molecular Weight:
317.2967
IUPAC Name:
N-(3-morpholin-4-ylphenyl)-5-nitrofuran-2-carboxamide
InChI:
InChI=1S/C15H15N3O5/c19-15(13-4-5-14(23-13)18(20)21)16-11-2-1-3-12(10-11)17-6-8-22-9-7-17/h1-5,10H,6-9H2,(H,16,19)
InChI Key:
JLJGABMGRBPQFR-UHFFFAOYSA-N
SMILES:
O=C(c1ccc(o1)[N+](=O)[O-])Nc1cccc(c1)N1CCOCC1
Properties
Complexity:
435
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
317.101g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
317.301g/mol
Monoisotopic Mass:
317.101g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
101A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
Literature
| Title | Journal |
|---|---|
| Nitrofurans as novel anti-tuberculosis agents: identification, development and evaluation. | Current topics in medicinal chemistry 20070101 |
| Synthesis and evaluation of cyclic secondary amine substituted phenyl and benzyl nitrofuranyl amides as novel antituberculosis agents. | Journal of medicinal chemistry 20051229 |
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