2,2'-(2-Vinylanthracene-9,10-diylidene)bis(1,3-dithiole)
Product Information
Molecular Formula
C22H14S4
Molecular Weight
406.59
Description
2,2'-(2-Vinylanthracene-9,10-diylidene)bis(1,3-dithiole) is a novel biosynthetic compound instrumental in oncological research. It has been attributed to mitigating drug resistance in cancer therapy, particularly for anthracycline-resistant tumor cells, thereby contributing to chemotherapy efficacy.
Synonyms
9,10-Bis(1,3-dithiol-2-ylidene)-2-vinylanthracene
IUPAC Name
2-[10-(1,3-dithiol-2-ylidene)-2-ethenylanthracen-9-ylidene]-1,3-dithiole
SMILES
C=CC1=CC2=C(C=C1)C(=C3SC=CS3)C4=CC=CC=C4C2=C5SC=CS5
InChI
InChI=1S/C22H14S4/c1-2-14-7-8-17-18(13-14)20(22-25-11-12-26-22)16-6-4-3-5-15(16)19(17)21-23-9-10-24-21/h2-13H,1H2
InChI Key
PVHQRJPHCJRMKB-UHFFFAOYSA-N
Purity
>98.0%(GC)
Appearance
Solid
Computed Properties
XLogP3
6.1
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
4
Rotatable Bond Count
1
Exact Mass
405.99783514 g/mol
Monoisotopic Mass
405.99783514 g/mol
Topological Polar Surface Area
101Ų
Heavy Atom Count
26
Formal Charge
0
Complexity
694
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes
