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Home > Nitro Compounds > 586410-18-6
586410-18-6 | 1,3-DiMethoxy-5-[2-(4-nitro-phenyl)-vinyl]-benzene
CAS No: 586410-18-6 Catalog No: AG00F2PG MDL No:MFCD16038081
Product Description
Catalog Number:
AG00F2PG
Chemical Name:
1,3-DiMethoxy-5-[2-(4-nitro-phenyl)-vinyl]-benzene
CAS Number:
586410-18-6
Molecular Formula:
C16H15NO4
Molecular Weight:
285.2946
MDL Number:
MFCD16038081
IUPAC Name:
1,3-dimethoxy-5-[(E)-2-(4-nitrophenyl)ethenyl]benzene
InChI:
InChI=1S/C16H15NO4/c1-20-15-9-13(10-16(11-15)21-2)4-3-12-5-7-14(8-6-12)17(18)19/h3-11H,1-2H3/b4-3+
InChI Key:
ZOKYIFYCPTXDCW-ONEGZZNKSA-N
SMILES:
COc1cc(/C=C/c2ccc(cc2)[N+](=O)[O-])cc(c1)OC
Properties
Complexity:
346
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
285.1g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
285.299g/mol
Monoisotopic Mass:
285.1g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
64.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
Literature
| Title | Journal |
|---|---|
| In vitro and in vivo studies on stilbene analogs as potential treatment agents for colon cancer. | European journal of medicinal chemistry 20100901 |
| Design, synthesis, and biological evaluation of resveratrol analogues as aromatase and quinone reductase 2 inhibitors for chemoprevention of cancer. | Bioorganic & medicinal chemistry 20100715 |
| Synthesis and biological evaluation of a library of resveratrol analogues as inhibitors of COX-1, COX-2 and NF-kappaB. | Bioorganic & medicinal chemistry 20090201 |
| Stilbene-based anticancer agents: resveratrol analogues active toward HL60 leukemic cells with a non-specific phase mechanism. | Bioorganic & medicinal chemistry letters 20060615 |
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