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Sirtuin modulator 5

CAT: 0804-HY-148322-06Size: 250 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-148322-06Size:250 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Sirtuin modulator 5 is a sirtuin modulating agent. Sirtuin modulator 5 can activate SIRT1 with a DC50 value of [1].
CAS Number
694469-31-3
UNSPSC
12352005
Hazard Statement
H302-H315-H319
Target
Sirtuin
Type
Reference compound
Related Pathways
Cell Cycle/DNA Damage; Epigenetics
Applications
Metabolism-protein/nucleotide metabolism
Field of Research
Cancer; Infection; Metabolic Disease; Inflammation/Immunology; Neurological Disease
Assay Protocol
https://www.medchemexpress.com/sirtuin-modulator-5.html
Solubility
10 mM in DMSO
Smiles
O=C(C1=CC(OC)=C(C(OC)=C1)OC)NC2=CC=CC(C3=CN4C=CC=C(C)C4=N3)=C2
Molecular Formula
C24H23N3O4
Molecular Weight
417.46
Precautions
P264-P270-P280-P302+P352-P305+P351+P338-P330-P362+P364-P501
References & Citations
[1]Michael Milburn, et al. Patent. WO2006094236A1.
Shipping Conditions
Room temperature
Scientific Category
Reference compound1
Clinical Information
No Development Reported
Isoform
SIRT1

Chemical Information

3,4,5-trimethoxy-N-(3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl)benzamide
CAS Number694469-31-3
PubChem CID1084380
IUPAC Name3,4,5-trimethoxy-N-[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide
Molecular FormulaC24H23N3O4
Molecular Weight417.5
XLogP4.5
Topological Polar Surface Area74.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Heavy Atom Count31
Formal Charge0
Complexity591
SMILES
CC1=CC=CN2C1=NC(=C2)C3=CC(=CC=C3)NC(=O)C4=CC(=C(C(=C4)OC)OC)OC
InChI
InChI=1S/C24H23N3O4/c1-15-7-6-10-27-14-19(26-23(15)27)16-8-5-9-18(11-16)25-24(28)17-12-20(29-2)22(31-4)21(13-17)30-3/h5-14H,1-4H3,(H,25,28)
InChIKey
FIRLMVXVEXHHQH-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3,4,5-trimethoxy-N-(3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl)benzamide
CAS: 694469-31-3
CID: 1084380
Formula: C24H23N3O4
MW: 417.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight417.5
XLogP34.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Exact Mass417.16885622
Monoisotopic Mass417.16885622
Topological Polar Surface Area74.1 Ų
Heavy Atom Count31
Formal Charge0
Complexity591
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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