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NSC20116

CAT: 0013-GTR19272994-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19272994-02Size:50 mg
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Description
NSC20116 is a uracil derivative that specifically targets the Set-and-Ring (SRA) domain of the oncogene UHRF1. It binds to the 5-methylcytosine (5mC) recognition pocket within the UHRF1SRA domain, with a dissociation constant (Kd) of 362 nM. NSC20116 is applicable for cancer research.
CAS Number
644-37-1
Smiles
O=NNC1=CNC (=O) NC1=O
Molecular Formula
C4H4N4O3
Molecular Weight
156.1
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

5-(Hydroxydiazenyl)pyrimidine-2,4-diol
CAS Number644-37-1
PubChem CID227928
IUPAC NameN-(2,4-dioxo-1H-pyrimidin-5-yl)nitrous amide
Molecular FormulaC4H4N4O3
Molecular Weight156.10
XLogP-1.1
Topological Polar Surface Area99.7
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count1
Heavy Atom Count11
Formal Charge0
Complexity246
SMILES
C1=C(C(=O)NC(=O)N1)NN=O
InChI
InChI=1S/C4H4N4O3/c9-3-2(7-8-11)1-5-4(10)6-3/h1H,(H,7,11)(H2,5,6,9,10)
InChIKey
OIXPJPUFFXAGLN-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 5-(Hydroxydiazenyl)pyrimidine-2,4-diol
CAS: 644-37-1
CID: 227928
Formula: C4H4N4O3
MW: 156.10
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight156.10
XLogP3-1.1
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count1
Exact Mass156.02834000
Monoisotopic Mass156.02834000
Topological Polar Surface Area99.7 Ų
Heavy Atom Count11
Formal Charge0
Complexity246
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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