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SIRT1 activator 2

CAT: 0804-HY-156023-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-156023-01Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
SIRT1 activator 2 (compound 212) is a SIRT1 activator with an ED50 of [1].
CAS Number
863589-52-0
UNSPSC
12352005
Hazard Statement
H315, H319
Target
Sirtuin
Type
Reference compound
Related Pathways
Cell Cycle/DNA Damage; Epigenetics
Applications
Metabolism-protein/nucleotide metabolism
Field of Research
Cancer; Metabolic Disease; Inflammation/Immunology; Neurological Disease; Cardiovascular Disease
Assay Protocol
https://www.medchemexpress.com/sirtuin-modulator-7.html
Purity
99.28
Solubility
DMSO : 5 mg/mL (ultrasonic; warming; heat to 60°C)
Smiles
O=C(C1=CC(OC)=CC=C1)NC2=CC=CC(C3=NC4=CC=CN=C4S3)=C2
Molecular Formula
C20H15N3O2S
Molecular Weight
361.42
Precautions
H315, H319
References & Citations
[1]Nunes, et al. Preparation of benzimidazole derivatives as sirtuin modulators. WO2007019416. 2007-02-15
Shipping Conditions
Room Temperature
Storage Conditions
-20°C, 3 years; 4°C, 2 years (Powder)
Scientific Category
Reference compound1
Clinical Information
No Development Reported
Isoform
SIRT1

Chemical Information

3-methoxy-N-(3-(thiazolo[5,4-b]pyridin-2-yl)phenyl)benzamide
CAS Number863589-52-0
PubChem CID3514815
IUPAC Name3-methoxy-N-[3-([1,3]thiazolo[5,4-b]pyridin-2-yl)phenyl]benzamide
Molecular FormulaC20H15N3O2S
Molecular Weight361.4
XLogP4.1
Topological Polar Surface Area92.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Heavy Atom Count26
Formal Charge0
Complexity492
SMILES
COC1=CC=CC(=C1)C(=O)NC2=CC=CC(=C2)C3=NC4=C(S3)N=CC=C4
InChI
InChI=1S/C20H15N3O2S/c1-25-16-8-3-5-13(12-16)18(24)22-15-7-2-6-14(11-15)19-23-17-9-4-10-21-20(17)26-19/h2-12H,1H3,(H,22,24)
InChIKey
FHUQJHXYDFDWJO-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3-methoxy-N-(3-(thiazolo[5,4-b]pyridin-2-yl)phenyl)benzamide
CAS: 863589-52-0
CID: 3514815
Formula: C20H15N3O2S
MW: 361.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight361.4
XLogP34.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Exact Mass361.08849790
Monoisotopic Mass361.08849790
Topological Polar Surface Area92.4 Ų
Heavy Atom Count26
Formal Charge0
Complexity492
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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