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Sirt1/2-IN-3

CAT: 0931-T79564-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0931-T79564-01Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
301313-42-8
Target
Sirtuin, Apoptosis
Related Pathways
Apoptosis, Chromatin/Epigenetic, DNA Damage/DNA Repair
Bioactivity
Sirt1/2-IN-3 (compound PS9) serves as a dual inhibitor of SIRT1/2, exhibiting IC50 values of 1.4 μM (SIRT1) and 2.0 μM (SIRT2), respectively. This compound effectively inhibits p53 deacetylation while simultaneously elevating p53 and α-tubulin acetylation levels. Additionally, Sirt1/2-IN-3 promotes apoptosis and exhibits antiproliferative effects on human leukemia cell lines [1].
Smiles
COC1=CC=C(C=C1)S(=O)(=O)NC1=C2C=CC=CC2=C(O)C(Cl)=C1
Molecular Formula
C17H14ClNO4S
Molecular Weight
363.82
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Sirt1/2-IN-3
CAS Number301313-42-8
PubChem CID1183798
IUPAC NameN-(3-chloro-4-hydroxynaphthalen-1-yl)-4-methoxybenzenesulfonamide
Molecular FormulaC17H14ClNO4S
Molecular Weight363.8
XLogP3.9
Topological Polar Surface Area84
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Heavy Atom Count24
Formal Charge0
Complexity515
SMILES
COC1=CC=C(C=C1)S(=O)(=O)NC2=CC(=C(C3=CC=CC=C32)O)Cl
InChI
InChI=1S/C17H14ClNO4S/c1-23-11-6-8-12(9-7-11)24(21,22)19-16-10-15(18)17(20)14-5-3-2-4-13(14)16/h2-10,19-20H,1H3
InChIKey
PBHNALRVEVSVQD-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Sirt1/2-IN-3
CAS: 301313-42-8
CID: 1183798
Formula: C17H14ClNO4S
MW: 363.8
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight363.8
XLogP33.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Exact Mass363.0332068
Monoisotopic Mass363.0332068
Topological Polar Surface Area84 Ų
Heavy Atom Count24
Formal Charge0
Complexity515
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
HY-155728Sirt1/2-IN-3
HY-114906-01SIRT1/2/3-IN-2
MBS5816828SIRT1/2/3-IN-1
BA4520-10SIRT1-IN-3
HY-146689-01SIRT1-IN-2
MBS5821225Sirt1/2-IN-2
sc-222315ASIRT1 Activator 3
HY-155729Sirt1/2-IN-4

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