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8Br-HA

CAT: 0013-GTR19189949-02Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19189949-02Size:10 mg
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Description
8Br-HA is a potent and selective inhibitor of the fragile histidine triad (FHIT) diadenosine triphosphatase, exhibiting an IC50 of 0.12 μM. It demonstrates anti-proliferative activity in vitro against HCC827 and H460 lung cancer cell lines, with GI50 values of 0.87 and 5.9 μM, respectively. This compound serves as a valuable chemical probe for investigating FHIT-related signaling pathways in cancer research.
CAS Number
2937864-01-0
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

2-[(4-bromo-6-oxo-7,8,9,10-tetrahydrobenzo[c]chromen-3-yl)oxy]-N-hydroxyacetamide
CAS Number2937864-01-0
PubChem CID163342013
IUPAC Name2-[(4-bromo-6-oxo-7,8,9,10-tetrahydrobenzo[c]chromen-3-yl)oxy]-N-hydroxyacetamide
Molecular FormulaC15H14BrNO5
Molecular Weight368.18
XLogP2.4
Topological Polar Surface Area84.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Heavy Atom Count22
Formal Charge0
Complexity506
SMILES
C1CCC2=C(C1)C3=C(C(=C(C=C3)OCC(=O)NO)Br)OC2=O
InChI
InChI=1S/C15H14BrNO5/c16-13-11(21-7-12(18)17-20)6-5-9-8-3-1-2-4-10(8)15(19)22-14(9)13/h5-6,20H,1-4,7H2,(H,17,18)
InChIKey
JXEJSQNJFCBFCR-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-[(4-bromo-6-oxo-7,8,9,10-tetrahydrobenzo[c]chromen-3-yl)oxy]-N-hydroxyacetamide
CAS: 2937864-01-0
CID: 163342013
Formula: C15H14BrNO5
MW: 368.18
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight368.18
XLogP32.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Exact Mass367.00554
Monoisotopic Mass367.00554
Topological Polar Surface Area84.9 Ų
Heavy Atom Count22
Formal Charge0
Complexity506
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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