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MHY553

CAT: 0931-T68974-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0931-T68974-02Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
6265-56-1
Target
Others, PPAR
Related Pathways
DNA Damage/DNA Repair, Metabolism, Others
Bioactivity
MHY 553 is a PPARα agonist that improved aged-induced hepatic steatosis.
Smiles
OC1=C(C2=NC=3C(S2)=CC=CC3)C=CC(O)=C1
Molecular Formula
C13H9NO2S
Molecular Weight
243.28
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

4-(2-Benzothiazolyl)-1,3-benzenediol
CAS Number6265-56-1
PubChem CID95746
IUPAC Name4-(1,3-benzothiazol-2-yl)benzene-1,3-diol
Molecular FormulaC13H9NO2S
Molecular Weight243.28
XLogP3.5
Topological Polar Surface Area81.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Heavy Atom Count17
Formal Charge0
Complexity276
SMILES
C1=CC=C2C(=C1)N=C(S2)C3=C(C=C(C=C3)O)O
InChI
InChI=1S/C13H9NO2S/c15-8-5-6-9(11(16)7-8)13-14-10-3-1-2-4-12(10)17-13/h1-7,15-16H
InChIKey
YQIRLDMXXRINIJ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4-(2-Benzothiazolyl)-1,3-benzenediol
CAS: 6265-56-1
CID: 95746
Formula: C13H9NO2S
MW: 243.28
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight243.28
XLogP33.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Exact Mass243.03539970
Monoisotopic Mass243.03539970
Topological Polar Surface Area81.6 Ų
Heavy Atom Count17
Formal Charge0
Complexity276
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

Alternative Products

CatalogName
MBS5811528MHY553

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