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CAY10722

CAT: 0013-GTR19191819-02Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19191819-02Size:10 mg
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Description
CAY10722 is a SIRT3 inhibitor (71% inhibition at 200 μM) used to study this NAD+-dependent mitochondrial deacetylase. Research applications include investigating SIRT3's context-dependent roles in cancer metabolism, utilizing both in vitro assays and in vivo xenograft models to explore its function as an oncogene or tumor suppressor.
CAS Number
388086-13-3
Field of Research
Epigenetics & Chromatin, Molecular Biology
Smiles
ClC1=CC (Cl) =C (C=C1) C1=NC2=C (O1) C=CC (NC (=O) CC1=CC=CC=C1) =C2
Molecular Formula
C21H14Cl2N2O2
Molecular Weight
397.25
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

N-[2-(2,4-dichlorophenyl)-1,3-benzoxazol-5-yl]-2-phenylacetamide
CAS Number388086-13-3
PubChem CID1359595
IUPAC NameN-[2-(2,4-dichlorophenyl)-1,3-benzoxazol-5-yl]-2-phenylacetamide
Molecular FormulaC21H14Cl2N2O2
Molecular Weight397.2
XLogP5.5
Topological Polar Surface Area55.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Heavy Atom Count27
Formal Charge0
Complexity514
SMILES
C1=CC=C(C=C1)CC(=O)NC2=CC3=C(C=C2)OC(=N3)C4=C(C=C(C=C4)Cl)Cl
InChI
InChI=1S/C21H14Cl2N2O2/c22-14-6-8-16(17(23)11-14)21-25-18-12-15(7-9-19(18)27-21)24-20(26)10-13-4-2-1-3-5-13/h1-9,11-12H,10H2,(H,24,26)
InChIKey
HUGVXMJZAPFVHU-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-[2-(2,4-dichlorophenyl)-1,3-benzoxazol-5-yl]-2-phenylacetamide
CAS: 388086-13-3
CID: 1359595
Formula: C21H14Cl2N2O2
MW: 397.2
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight397.2
XLogP35.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Exact Mass396.0432331
Monoisotopic Mass396.0432331
Topological Polar Surface Area55.1 Ų
Heavy Atom Count27
Formal Charge0
Complexity514
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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