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OUL232

CAT: 0013-GTR19243676-01Size: 500 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19243676-01Size:500 mg
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Description
OUL232 is a potent inhibitor of mono-ARTs PARP7, PARP10, PARP11, PARP12, PARP14, and PARP15. OUL232 is the most potent PARP10 inhibitor described to date (IC50=7.8 nM), as well as the first PARP12 inhibitor ever reported.
CAS Number
943119-42-4
Purity
>98% (HPLC)
Solubility
In Vitro: DMSO : 50 mg/mL (199.78 mM; ultrasonic and warming and adjust pH to 2 with 1M HCl and heat to 80°C)
Smiles
N=1N=C (N) N2C1SC=3C (OC) =CC=C (OC) C32
Molecular Formula
C10H10N4O2S
Molecular Weight
250.28
Storage Conditions
Storage temperature: -20°C. Stability: ≥ 2 years
Notes
For research use only.

Chemical Information

5,8-Dimethoxy-[1,2,4]triazolo[3,4-b][1,3]benzothiazol-1-amine
CAS Number943119-42-4
PubChem CID2771058
IUPAC Name5,8-dimethoxy-[1,2,4]triazolo[3,4-b][1,3]benzothiazol-1-amine
Molecular FormulaC10H10N4O2S
Molecular Weight250.28
XLogP2.3
Topological Polar Surface Area103
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count2
Heavy Atom Count17
Formal Charge0
Complexity295
SMILES
COC1=C2C(=C(C=C1)OC)SC3=NN=C(N23)N
InChI
InChI=1S/C10H10N4O2S/c1-15-5-3-4-6(16-2)8-7(5)14-9(11)12-13-10(14)17-8/h3-4H,1-2H3,(H2,11,12)
InChIKey
FSNNMBVVDWKKCB-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 5,8-Dimethoxy-[1,2,4]triazolo[3,4-b][1,3]benzothiazol-1-amine
CAS: 943119-42-4
CID: 2771058
Formula: C10H10N4O2S
MW: 250.28
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight250.28
XLogP32.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count2
Exact Mass250.05244675
Monoisotopic Mass250.05244675
Topological Polar Surface Area103 Ų
Heavy Atom Count17
Formal Charge0
Complexity295
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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