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Tariquidar

CAT: 0013-GTR19162829-01Size: 200 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19162829-01Size:200 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
A potent, specific P-gp inhibitor with Kd of 5.1 nM; potentiates the cytotoxicity of several drugs including doxorubicin, paclitaxel, etoposide, and vincristine in a panel of human MDR cell lines at 25-80 nM; exhibits potent i.v. and p.o. activity without apparently enhancing the plasma pharmacokinetics of paclitaxel or the toxicity of coadministered drugs.Breast Cancer Phase 2 Discontinued.
CAS Number
206873-63-4
Product Name Alternative
XR 9576 | XR-9576 | XR9576
Purity
>98% (HPLC)
Solubility
DMSO: ≥ 100 mg/mL
Smiles
COC1=CC2=C (CN (CCC3=CC=C (NC (=O) C4=C (NC (=O) C5=CC6=CC=CC=C6N=C5) C=C (OC) C (OC) =C4) C=C3) CC2) C=C1OC |c:17,26,28,31,40,43,49, t:2,4,10,12,22,24,34|
Molecular Formula
C38H38N4O6
Molecular Weight
646.7315
Storage Conditions
Storage temperature: -20°C. Stability: ≥ 2 years
Notes
For research use only.
Other Product Names
3-Quinolinecarboxamide, N-[2-[[[4-[2- (3,4-dihydro-6,7-dimethoxy-2 (1H) -isoquinolinyl) ethyl]phenyl]amino]carbonyl]-4,5-dimethoxyphenyl]-

Chemical Information

Tariquidar

Tariquidar is a member of benzamides.

CAS Number206873-63-4
PubChem CID148201
IUPAC NameN-[2-[[4-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]phenyl]carbamoyl]-4,5-dimethoxyphenyl]quinoline-3-carboxamide
Molecular FormulaC38H38N4O6
Molecular Weight646.7
XLogP6.1
Topological Polar Surface Area111
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count8
Rotatable Bond Count11
Heavy Atom Count48
Formal Charge0
Complexity1040
SMILES
COC1=C(C=C2CN(CCC2=C1)CCC3=CC=C(C=C3)NC(=O)C4=CC(=C(C=C4NC(=O)C5=CC6=CC=CC=C6N=C5)OC)OC)OC
InChI
InChI=1S/C38H38N4O6/c1-45-33-18-25-14-16-42(23-28(25)19-34(33)46-2)15-13-24-9-11-29(12-10-24)40-38(44)30-20-35(47-3)36(48-4)21-32(30)41-37(43)27-17-26-7-5-6-8-31(26)39-22-27/h5-12,17-22H,13-16,23H2,1-4H3,(H,40,44)(H,41,43)
InChIKey
LGGHDPFKSSRQNS-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Tariquidar
CAS: 206873-63-4
CID: 148201
Formula: C38H38N4O6
MW: 646.7
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight646.7
XLogP36.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count8
Rotatable Bond Count11
Exact Mass646.27913494
Monoisotopic Mass646.27913494
Topological Polar Surface Area111 Ų
Heavy Atom Count48
Formal Charge0
Complexity1040
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

Alternative Products

CatalogName
202820Tariquidar
MBS5786050Tariquidar dimesylate
HY-10550BTariquidar (dimesylate)

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