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Chemical structure of Bractoppin

GC62128

Bractoppin

Also known as [4-[(2-fluorophenyl)methyl]piperazin-1-yl]-(2-phenyl-3H-benzimidazol-5-yl)methanone

Bractoppin is a tandem BRCT (tandem BRCT, BRCA1) delivered by human breast and ovarian cancer suppressor protein (BRCA1) tBRCT domain recognizes a drug-like inhibitor of phosphopeptide that selectively inhibits nanomolar activity of substrate binding in vitro with an IC50 of 0·074 μM

ChemicalCAS2290527-07-8MW414.47FormulaC25H23FN4O
CAS number
2290527-07-8
Molecular weight
414.47
Formula
C25H23FN4O
Solubility
DMSO ： 250 mg/mL (603·18 mM; Need ultrasonic)
InChIKey
UHDGSNOZRAAGIZ-UHFFFAOYSA-N
Catalogue number
GC62128
Brand
GLPBIO
Computed properties PubChem CID 137519541 · XLogP 4 · TPSA 52.2 Ų · H-bond donors 1
XLogP
4
TPSA
52.2 Ų
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
31

SMILES C1CN(CCN1CC2=CC=CC=C2F)C(=O)C3=CC4=C(C=C3)N=C(N4)C5=CC=CC=C5

Computed descriptors from PubChem (CID 137519541), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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Pricing
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Documents
Lot certificate of analysis and manufacturer SDS are emailed with your order confirmation.
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