Products for Research Use Only
RegisterLogin

FD 12-9

CAT: 0804-HY-128685Size: 1 EachDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0804-HY-128685Size:1 Each
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
Description
FD 12-9 is a flavonoid dimer, acts as a dual inhibitor of P-gp and BCRP, with EC50s of 285 nM and 0.9 nM, respectively. Anti-glioblastoma activity[1].
CAS Number
1451741-22-2
Product Name Alternative
Ac12Az9
UNSPSC
12352005
Target
BCRP; P-glycoprotein
Type
Reference compound
Related Pathways
Membrane Transporter/Ion Channel
Applications
Cancer-programmed cell death
Field of Research
Cancer
Assay Protocol
https://www.medchemexpress.com/fd-12-9.html
Solubility
10 mM in DMSO
Smiles
O=C(OC)C1=CC=CC(COC2=C(C3=CC=C(OCCOCCOCCN4N=NC(CCCCOC5=CC=C6C(C=C(C7=CC=CC=C7)OC6=C5)=O)=C4)C=C3)OC8=CC=CC=C8C2=O)=C1
Molecular Formula
C51H47N3O11
Molecular Weight
877.93
References & Citations
[1]Hu Xuesen, et al. Developing a novel strategy to treat glioblastoma : improving brain bioavailability of sorafenib with a synthetic flavonoid dimer to inhibit drug efflux in blood brain barrier.
Shipping Conditions
Room temperature
Scientific Category
Reference compound1
Clinical Information
No Development Reported

Chemical Information

Methyl 3-[[4-oxo-2-[4-[2-[2-[2-[4-[4-(4-oxo-2-phenylchromen-7-yl)oxybutyl]triazol-1-yl]ethoxy]ethoxy]ethoxy]phenyl]chromen-3-yl]oxymethyl]benzoate
CAS Number1451741-22-2
PubChem CID89795330
IUPAC Namemethyl 3-[[4-oxo-2-[4-[2-[2-[2-[4-[4-(4-oxo-2-phenylchromen-7-yl)oxybutyl]triazol-1-yl]ethoxy]ethoxy]ethoxy]phenyl]chromen-3-yl]oxymethyl]benzoate
Molecular FormulaC51H47N3O11
Molecular Weight877.9
XLogP7.7
Topological Polar Surface Area156
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count13
Rotatable Bond Count23
Heavy Atom Count65
Formal Charge0
Complexity1590
SMILES
COC(=O)C1=CC=CC(=C1)COC2=C(OC3=CC=CC=C3C2=O)C4=CC=C(C=C4)OCCOCCOCCN5C=C(N=N5)CCCCOC6=CC7=C(C=C6)C(=O)C=C(O7)C8=CC=CC=C8
InChI
InChI=1S/C51H47N3O11/c1-58-51(57)38-13-9-10-35(30-38)34-63-50-48(56)43-15-5-6-16-45(43)65-49(50)37-17-19-40(20-18-37)62-29-28-60-27-26-59-25-23-54-33-39(52-53-54)14-7-8-24-61-41-21-22-42-44(55)32-46(64-47(42)31-41)36-11-3-2-4-12-36/h2-6,9-13,15-22,30-33H,7-8,14,23-29,34H2,1H3
InChIKey
WDTNQVLDVIDALR-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Methyl 3-[[4-oxo-2-[4-[2-[2-[2-[4-[4-(4-oxo-2-phenylchromen-7-yl)oxybutyl]triazol-1-yl]ethoxy]ethoxy]ethoxy]phenyl]chromen-3-yl]oxymethyl]benzoate
CAS: 1451741-22-2
CID: 89795330
Formula: C51H47N3O11
MW: 877.9
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight877.9
XLogP37.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count13
Rotatable Bond Count23
Exact Mass877.32105932
Monoisotopic Mass877.32105932
Topological Polar Surface Area156 Ų
Heavy Atom Count65
Formal Charge0
Complexity1590
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
HY-133852-01FD-1080
HY-114461FD-895
HY-N8409FD-838
HY-128570-01FD-IN-1
HY-175558MMP-9-IN-12
HY-D2294-01FD dye 7
HY-133878-01Octadeca-9,12-dienamide
HY-N2063-0112-Ethyl-9-hydroxycamptothecin
HY-W127564Cholesteryl 9,12-octadecadienoate
HY-114461B(3S,17S) -FD-895

Alternative Products

CatalogName
TRC-H714624-2.5MGCortisol-9,12,12-d3
T212289-01MMP-9-IN-12
MBS3842857-01FD 12-9
TRC-C696302-0.5MGCortisol-9,11,12,12-d4
PC1078849,9,10,10,11,11,12,12,12-Nonafluorododecane-1-thiol
PC1078839,9,10,10,11,11,12,12,12-Nonafluorododecan-1-ol
CS-I-00456Corticosterone-[9,11,12,12-d4]
TPL0171-01Compound 174610-12-9
A18393-50FD 12-9 50mg
A18393-25FD 12-9 25mg

Popular Products