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BXI-72

CAT: 0013-GTR19162990-05Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19162990-05Size:25 mg
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Description
BXI-72 (NSC334072, Hoechst 33342) is a potent, selective small molecule Bcl-XL inhibitor that targets the BH3 domain of Bcl-XL (Kd=0.9 nM) ; displays very low binding affinities with Bcl2 (Ki=283 nM), Mcl-1, Bcl-w and Bfl-1/A1 (Ki>1500 nM) ; potently suppresses lung cancer cell growth (H1299=0.49 uM, A549 IC50=0.68 uM), displays relatively selective cytotoxicity against lung cancer cells compared to normal human bronchial epithelial cells; caunses disruption of Bcl-XL/Bak or Bcl-XL/Bax interaction, oligomerization of Bak, and cytochrome c release from mitochondria in cells, BXI-72 exhibits more potent efficacy against human lung cancer than ABT-737 but less degree in platelet reduction in vivo.
CAS Number
23491-52-3
Product Name Alternative
NSC334072 | Bcl-XL inhibitor BXI-72 | Hoechst 33342
Purity
>98% (HPLC)
Solubility
In Vitro: DMSO : 6.25 mg/mL (13.81 mM)
Smiles
CN1CCN (C2=CC=C3C (N=C (C4=CC=C5C (N=C (C6=CC=C (OCC) C=C6) N5) =C4) N3) =C2) CC1.[H]Cl.[H]Cl.[H]Cl
Molecular Formula
C27H29ClN6O
Molecular Weight
489.01
Storage Conditions
Storage temperature: -20°C. Stability: ≥ 2 years
Notes
For research use only.
Other Product Names
2'- (4-ethoxyphenyl) -5- (4-methylpiperazin-1-yl) -1H,1'H-2,5'-bibenzo[d]imidazole

Chemical Information

Bisbenzimide

2'-(4-ethoxyphenyl)-5-(4-methylpiperazin-1-yl)-2,5'-bibenzimidazole is a bibenzimidazole and a N-methylpiperazine. It has a role as a fluorochrome. It is functionally related to a pibenzimol.

CAS Number23491-52-3
PubChem CID1464
IUPAC Name2-(4-ethoxyphenyl)-6-[6-(4-methylpiperazin-1-yl)-1H-benzimidazol-2-yl]-1H-benzimidazole
Molecular FormulaC27H28N6O
Molecular Weight452.6
XLogP4.6
Topological Polar Surface Area73.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Heavy Atom Count34
Formal Charge0
Complexity664
SMILES
CCOC1=CC=C(C=C1)C2=NC3=C(N2)C=C(C=C3)C4=NC5=C(N4)C=C(C=C5)N6CCN(CC6)C
InChI
InChI=1S/C27H28N6O/c1-3-34-21-8-4-18(5-9-21)26-28-22-10-6-19(16-24(22)30-26)27-29-23-11-7-20(17-25(23)31-27)33-14-12-32(2)13-15-33/h4-11,16-17H,3,12-15H2,1-2H3,(H,28,30)(H,29,31)
InChIKey
PRDFBSVERLRRMY-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Bisbenzimide
CAS: 23491-52-3
CID: 1464
Formula: C27H28N6O
MW: 452.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight452.6
XLogP34.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Exact Mass452.23245954
Monoisotopic Mass452.23245954
Topological Polar Surface Area73.1 Ų
Heavy Atom Count34
Formal Charge0
Complexity664
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

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Alternative Products

CatalogName
M13672-01BXI-72
ABC-TC0036A-72
138595-AFTAG-72 (Tumor-associated Glycoprotein 72, TAG 72)
172153-01TAG-72 (CA 72.4, Tumor Associated GlycoProtein 72)
MBS6122470-01TAG-72 (Tumor-associated Glycoprotein 72, TAG 72) (PE)
138595-AF-BiotinTAG-72 (Tumor-associated Glycoprotein 72, TAG 72) (Biotin)
MBS6122465-01TAG-72 (Tumor-associated Glycoprotein 72, TAG 72) (AP)
138595-AF-FITCTAG-72 (Tumor-associated Glycoprotein 72, TAG 72) (FITC)
MBS6122469-01TAG-72 (Tumor-associated Glycoprotein 72, TAG 72) (HRP)
MBS6122466-01TAG-72 (Tumor-associated Glycoprotein 72, TAG 72) (APC)

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