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119755-10-1 | 2,5-Furandione, 3,4-bis(3,4-dimethoxyphenyl)-
CAS No: 119755-10-1 Catalog No: AG000PLK MDL No:
Product Description
Catalog Number:
AG000PLK
Chemical Name:
2,5-Furandione, 3,4-bis(3,4-dimethoxyphenyl)-
CAS Number:
119755-10-1
Molecular Formula:
C20H18O7
Molecular Weight:
370.3527
IUPAC Name:
3,4-bis(3,4-dimethoxyphenyl)furan-2,5-dione
InChI:
InChI=1S/C20H18O7/c1-23-13-7-5-11(9-15(13)25-3)17-18(20(22)27-19(17)21)12-6-8-14(24-2)16(10-12)26-4/h5-10H,1-4H3
InChI Key:
BVBPNZGHDANZJT-UHFFFAOYSA-N
SMILES:
COc1cc(ccc1OC)C1=C(C(=O)OC1=O)c1ccc(c(c1)OC)OC
Properties
Complexity:
549
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
370.105g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
370.357g/mol
Monoisotopic Mass:
370.105g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
80.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
Literature
| Title | Journal |
|---|---|
| Catechol-substituted L-chicoric acid analogues as HIV integrase inhibitors. | Bioorganic & medicinal chemistry letters 20031215 |
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