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RAD51 Inhibitor B02

CAT: 0013-GTR19170464-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19170464-01Size:5 mg
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Description
B02 is a small molecule inhibitor of the human RAD51 recombinase, exhibiting an IC50 of 27.4 μM. It is widely used in research to study DNA repair mechanisms, particularly homologous recombination, and has been applied in both in vitro assays and in vivo models to investigate cancer biology and potential therapeutic strategies.
CAS Number
1290541-46-6
Product Name Alternative
RAD51 Inhibitor B02, RAD-51 Inhibitor B02, RAD51, RNA Synthesis, RNASynthesis, Inhibitor, inhibit, Apoptosis, B 02, B02, B-02, DNA Synthesis, DNASynthesis
Field of Research
Cell Biology, Epigenetics & Chromatin; Pharmacology & Drug Discovery, Molecular Biology
Purity
99.72% (May vary between batches)
Solubility
10% DMSO+40% PEG300+5% Tween 80+45% Saline:2 mg/mL (5.89 mM) ; DMSO:33.9 mg/mL (99.89 mM)
Smiles
O=c1n (Cc2ccccc2) c (\C=C\c2cccnc2) nc2ccccc12
Molecular Formula
C22H17N3O
Molecular Weight
339.39
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

((E)-3-benzyl-2-(2-(pyridin-3-yl)vinyl)quinazolin-4-(3H)-one)

3-(phenylmethyl)-2-[2-(3-pyridinyl)ethenyl]-4-quinazolinone is a member of quinazolines.

CAS Number1290541-46-6
PubChem CID5738263
IUPAC Name3-benzyl-2-[(E)-2-pyridin-3-ylethenyl]quinazolin-4-one
Molecular FormulaC22H17N3O
Molecular Weight339.4
XLogP3.4
Topological Polar Surface Area45.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Heavy Atom Count26
Formal Charge0
Complexity550
SMILES
C1=CC=C(C=C1)CN2C(=NC3=CC=CC=C3C2=O)/C=C/C4=CN=CC=C4
InChI
InChI=1S/C22H17N3O/c26-22-19-10-4-5-11-20(19)24-21(13-12-17-9-6-14-23-15-17)25(22)16-18-7-2-1-3-8-18/h1-15H,16H2/b13-12+
InChIKey
GEKDQXSPTHHANP-OUKQBFOZSA-N
Chemical Structure
2D Structure
2D structure of ((E)-3-benzyl-2-(2-(pyridin-3-yl)vinyl)quinazolin-4-(3H)-one)
CAS: 1290541-46-6
CID: 5738263
Formula: C22H17N3O
MW: 339.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight339.4
XLogP33.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Exact Mass339.137162174
Monoisotopic Mass339.137162174
Topological Polar Surface Area45.6 Ų
Heavy Atom Count26
Formal Charge0
Complexity550
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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