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Biricodar

CAT: 0013-GTR19203920-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19203920-01Size:25 mg
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Description
Biricodar is a third-generation modulator that inhibits the drug efflux functions of P-glycoprotein (P-gp/ABCB1) and Multidrug Resistance-Associated Protein 1 (MRP-1/ABCC1) . It is utilized in vitro and in vivo research to investigate and overcome multidrug resistance (MDR) in cancer chemotherapy.
CAS Number
159997-94-1
Field of Research
Neuroscience, Pharmacology & Drug Discovery
Smiles
COc1cc (cc (OC) c1OC) C (=O) C (=O) N1CCCC[C@H]1C (=O) OC (CCCc1cccnc1) CCCc1cccnc1
Molecular Formula
C34H41N3O7
Molecular Weight
603.71
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Biricodar

Biricodar is an alpha-amino acid ester.

CAS Number159997-94-1
PubChem CID3037617
IUPAC Name1,7-dipyridin-3-ylheptan-4-yl (2S)-1-[2-oxo-2-(3,4,5-trimethoxyphenyl)acetyl]piperidine-2-carboxylate
Molecular FormulaC34H41N3O7
Molecular Weight603.7
XLogP5.2
Topological Polar Surface Area117
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count9
Rotatable Bond Count16
Heavy Atom Count44
Formal Charge0
Complexity866
SMILES
COC1=CC(=CC(=C1OC)OC)C(=O)C(=O)N2CCCC[C@H]2C(=O)OC(CCCC3=CN=CC=C3)CCCC4=CN=CC=C4
InChI
InChI=1S/C34H41N3O7/c1-41-29-20-26(21-30(42-2)32(29)43-3)31(38)33(39)37-19-5-4-16-28(37)34(40)44-27(14-6-10-24-12-8-17-35-22-24)15-7-11-25-13-9-18-36-23-25/h8-9,12-13,17-18,20-23,27-28H,4-7,10-11,14-16,19H2,1-3H3/t28-/m0/s1
InChIKey
CGVWPQOFHSAKRR-NDEPHWFRSA-N
Chemical Structure
2D Structure
2D structure of Biricodar
CAS: 159997-94-1
CID: 3037617
Formula: C34H41N3O7
MW: 603.7
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight603.7
XLogP35.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count9
Rotatable Bond Count16
Exact Mass603.29445066
Monoisotopic Mass603.29445066
Topological Polar Surface Area117 Ų
Heavy Atom Count44
Formal Charge0
Complexity866
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
C01869-01Biricodar
HY-13574Biricodar (dicitrate)
A21464-100Biricodar 100mg
BUP02219-01Biricodar dicitrate
A21464-25Biricodar 25mg
A21464-5Biricodar 5mg
A21464-1Biricodar 1mg
A21464-50Biricodar 50mg
A21464-10Biricodar 10mg
A13533-5Biricodar dicitrate 5mg

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