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Biricodar

CAT: 1568-C01869-04Size: 1 gDry Ice: NoHazardous: No
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CAT#:1568-C01869-04Size:1 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
159997-94-1
Synonyms
VX-710
SKU
C01869-5mg
Target
P-gp
Applications
Neuronal Signaling
Additionnal Information
Biricodar (VX-710) is a modulator of P-glycoprotein and MRP-1 with minimal in vivo toxicity. It enhances the effectiveness of various antibiotics against numerous gram-positive pathogens and exhibits potent chemosensitizing properties in cells resistant to multiple drugs.
Storage Conditions
2 years -20°C liquid

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...
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