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RK33

CAT: 0931-T6970-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0931-T6970-02Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1070773-09-9
Target
DNA/RNA Synthesis, SARS-CoV, COX
Related Pathways
Immunology/Inflammation, Neuroscience, DNA Damage/DNA Repair, Microbiology/Virology, Cell Cycle/Checkpoint
Purity
0.9972
Bioactivity
RK33 (RK 33) is a first-in-class small molecule inhibitor of DDX3 (a RNA helicase) and causes G1 cell cycle arrest, induces apoptosis, and promotes radiation sensitization in DDX3-overexpressing cells.
Smiles
COc1ccc(Cn2cnc3c4nc(=O)n(Cc5ccc(OC)cc5)c4ncnc23)cc1
Molecular Formula
C23H20N6O3
Molecular Weight
428.44
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

3,7-dihydro-3,7-bis((4-methoxyphenyl)methyl)-2H-diimidazo(4,5-d:4',5'-f)(1,3)diazepin-2-one

inhibits DDX3 RNA helicase

CAS Number1070773-09-9
PubChem CID46184988
IUPAC Name5,11-bis[(4-methoxyphenyl)methyl]-3,5,7,9,11,13-hexazatricyclo[8.3.0.02,6]trideca-1(10),2,6,8,12-pentaen-4-one
Molecular FormulaC23H20N6O3
Molecular Weight428.4
XLogP2.6
Topological Polar Surface Area93.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Heavy Atom Count32
Formal Charge0
Complexity783
SMILES
COC1=CC=C(C=C1)CN2C=NC3=C2N=CN=C4C3=NC(=O)N4CC5=CC=C(C=C5)OC
InChI
InChI=1S/C23H20N6O3/c1-31-17-7-3-15(4-8-17)11-28-14-26-19-20-22(25-13-24-21(19)28)29(23(30)27-20)12-16-5-9-18(32-2)10-6-16/h3-10,13-14H,11-12H2,1-2H3
InChIKey
COUMZXFUZDBRCZ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3,7-dihydro-3,7-bis((4-methoxyphenyl)methyl)-2H-diimidazo(4,5-d:4',5'-f)(1,3)diazepin-2-one
CAS: 1070773-09-9
CID: 46184988
Formula: C23H20N6O3
MW: 428.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight428.4
XLogP32.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Exact Mass428.15968852
Monoisotopic Mass428.15968852
Topological Polar Surface Area93.7 Ų
Heavy Atom Count32
Formal Charge0
Complexity783
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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Alternative Products

CatalogName
BUP05962-01RK33

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