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PUL89 Endonuclease-IN-2

CAT: 0931-T61840-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0931-T61840-01Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
519021-48-8
Target
Others, Virus Protease
Related Pathways
Others, Microbiology/Virology
Bioactivity
PUL89 Endonuclease-IN-2 (Compound 15k) is a highly effective inhibitor of the pUL89 endonuclease of human cytomegalovirus (HCMV), demonstrating potent antiviral activities with an IC50 of 3.0 μM [1].
Smiles
C(NCC1=CC=C(C(F)(F)F)C=C1)(=O)C=2NC(=NC(=O)C2O)C3=CC=CS3
Molecular Formula
C17H12F3N3O3S
Molecular Weight
395.36
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

pUL89 Endonuclease-IN-2
CAS Number519021-48-8
PubChem CID135601703
IUPAC Name5-hydroxy-6-oxo-2-thiophen-2-yl-N-[[4-(trifluoromethyl)phenyl]methyl]-1H-pyrimidine-4-carboxamide
Molecular FormulaC17H12F3N3O3S
Molecular Weight395.4
XLogP3.2
Topological Polar Surface Area119
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count8
Rotatable Bond Count4
Heavy Atom Count27
Formal Charge0
Complexity670
SMILES
C1=CSC(=C1)C2=NC(=C(C(=O)N2)O)C(=O)NCC3=CC=C(C=C3)C(F)(F)F
InChI
InChI=1S/C17H12F3N3O3S/c18-17(19,20)10-5-3-9(4-6-10)8-21-15(25)12-13(24)16(26)23-14(22-12)11-2-1-7-27-11/h1-7,24H,8H2,(H,21,25)(H,22,23,26)
InChIKey
GXHIOUVOPIQEGR-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of pUL89 Endonuclease-IN-2
CAS: 519021-48-8
CID: 135601703
Formula: C17H12F3N3O3S
MW: 395.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight395.4
XLogP33.2
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count8
Rotatable Bond Count4
Exact Mass395.05514691
Monoisotopic Mass395.05514691
Topological Polar Surface Area119 Ų
Heavy Atom Count27
Formal Charge0
Complexity670
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

Related Products

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TRP-00529-01Endonuclease IV
T211218-01PAN endonuclease-IN-4
T210780-01PAN endonuclease-IN-3
TRP-00589-01T4 endonuclease VII
TRP-00533-01T4 Endonuclease V
T87097-01PAN endonuclease-IN-1

Alternative Products

CatalogName
HY-146271PUL89 Endonuclease-IN-2
MBS5803107pUL89 Endonuclease-IN-1
GTR19262139-01PAN endonuclease-IN-2
HY-143743Cap-dependent endonuclease-IN-2
E2291-38AEndonuclease
486740NEIL2 (Endonuclease 8-like 2, Nei Endonuclease VIII-like 2 (E. coli) )
480186ENDOG (Endonuclease G, Mitochondrial, Endonuclease G)
E2291-38BEndonuclease (Biotin)
9253-50Benzo-Endonuclease
D6781LEndonuclease VIII

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