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PARP10/15-IN-2

CAT: 0013-GTR19187905Size: 500 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19187905Size:500 mg
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Description
PARP10/15-IN-2
CAS Number
2892064-99-0
Field of Research
Cell Biology, Epigenetics & Chromatin, Molecular Biology
Smiles
FC1=C (COC2=CC (C (NNC3=O) =O) =C3C=C2) C=CC=C1
Molecular Formula
C15H11FN2O3
Molecular Weight
286.26
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Parp10/15-IN-2
CAS Number2892064-99-0
PubChem CID163409145
IUPAC Name6-[(2-fluorophenyl)methoxy]-2,3-dihydrophthalazine-1,4-dione
Molecular FormulaC15H11FN2O3
Molecular Weight286.26
XLogP2
Topological Polar Surface Area67.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Heavy Atom Count21
Formal Charge0
Complexity418
SMILES
C1=CC=C(C(=C1)COC2=CC3=C(C=C2)C(=O)NNC3=O)F
InChI
InChI=1S/C15H11FN2O3/c16-13-4-2-1-3-9(13)8-21-10-5-6-11-12(7-10)15(20)18-17-14(11)19/h1-7H,8H2,(H,17,19)(H,18,20)
InChIKey
GJJIICZAOJXOEJ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Parp10/15-IN-2
CAS: 2892064-99-0
CID: 163409145
Formula: C15H11FN2O3
MW: 286.26
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight286.26
XLogP32
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Exact Mass286.07537038
Monoisotopic Mass286.07537038
Topological Polar Surface Area67.4 Ų
Heavy Atom Count21
Formal Charge0
Complexity418
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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