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UNC2327

CAT: 0804-HY-110158Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-110158Size:1 mg
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Description
UNC2327 is an allosteric inhibitor of protein arginine methyltransferase 3 (PRMT3) .
CAS Number
1426152-53-5
UNSPSC
12352005
Target
Histone Methyltransferase
Type
Reference compound
Related Pathways
Epigenetics
Applications
Cancer-programmed cell death
Field of Research
Cancer
Assay Protocol
https://www.medchemexpress.com/unc2327.html
Purity
99.70
Solubility
DMF : 10 mg/mL (ultrasonic; warming)
Smiles
O=C(NCC(N1CCCCC1)=O)NC2=CC3=C(N=NS3)C=C2
Molecular Formula
C14H17N5O2S
Molecular Weight
319.38
References & Citations
[1]Liu F, et al. Exploiting an allosteric binding site of PRMT3 yields potent and selective inhibitors. J Med Chem. 2013 Mar 14;56 (5) :2110-24.
Shipping Conditions
Blue Ice
Storage Conditions
-20°C, 3 years (Powder)
Scientific Category
Reference compound1
Clinical Information
No Development Reported
Isoform
PRMT3

Chemical Information

N-1,2,3-Benzothiadiazol-6-yl-N'-[2-oxo-2-(1-piperidinyl)ethyl]urea
CAS Number1426152-53-5
PubChem CID71583615
IUPAC Name1-(1,2,3-benzothiadiazol-6-yl)-3-(2-oxo-2-piperidin-1-ylethyl)urea
Molecular FormulaC14H17N5O2S
Molecular Weight319.38
XLogP1.2
Topological Polar Surface Area115
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Heavy Atom Count22
Formal Charge0
Complexity416
SMILES
C1CCN(CC1)C(=O)CNC(=O)NC2=CC3=C(C=C2)N=NS3
InChI
InChI=1S/C14H17N5O2S/c20-13(19-6-2-1-3-7-19)9-15-14(21)16-10-4-5-11-12(8-10)22-18-17-11/h4-5,8H,1-3,6-7,9H2,(H2,15,16,21)
InChIKey
MYTRGTBDVGKKRO-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-1,2,3-Benzothiadiazol-6-yl-N'-[2-oxo-2-(1-piperidinyl)ethyl]urea
CAS: 1426152-53-5
CID: 71583615
Formula: C14H17N5O2S
MW: 319.38
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight319.38
XLogP31.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Exact Mass319.11029598
Monoisotopic Mass319.11029598
Topological Polar Surface Area115 Ų
Heavy Atom Count22
Formal Charge0
Complexity416
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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