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DHX9-IN-11

CAT: 0804-HY-157605Size: 1 EachDry Ice: NoHazardous: No
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CAT#:0804-HY-157605Size:1 Each
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Description
DHX9-IN-11 (469) is a RNA helicase DHX9 inhibitor, with an EC50 of 0.0838 μM in DHX9 cellular target engagement. Used in cancer research[1].
CAS Number
2973402-91-2
UNSPSC
12352005
Target
DNA/RNA Synthesis
Type
Reference compound
Related Pathways
Cell Cycle/DNA Damage
Applications
Cancer-programmed cell death
Field of Research
Cancer
Assay Protocol
https://www.medchemexpress.com/dhx9-in-11.html
Solubility
10 mM in DMSO
Smiles
O=C(C1=CN(C)C(C2=C(F)C=C(N3CCC(F)(CC3)F)C=N2)=C1)NC4=CC(Cl)=CC(NS(=O)(C)=O)=C4
Molecular Formula
C23H23ClF3N5O3S
Molecular Weight
541.97
References & Citations
[1]Matthew H, et al. Inhibitors of rna helicase dhx9 and uses thereof. Patent WO2023154519.
Shipping Conditions
Room temperature
Scientific Category
Reference compound1
Clinical Information
No Development Reported

Chemical Information

Dhx9-IN-11
CAS Number2973402-91-2
PubChem CID169761213
IUPAC NameN-[3-chloro-5-(methanesulfonamido)phenyl]-5-[5-(4,4-difluoropiperidin-1-yl)-3-fluoro-2-pyridinyl]-1-methylpyrrole-3-carboxamide
Molecular FormulaC23H23ClF3N5O3S
Molecular Weight542.0
XLogP3.1
Topological Polar Surface Area105
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count9
Rotatable Bond Count6
Heavy Atom Count36
Formal Charge0
Complexity885
SMILES
CN1C=C(C=C1C2=C(C=C(C=N2)N3CCC(CC3)(F)F)F)C(=O)NC4=CC(=CC(=C4)Cl)NS(=O)(=O)C
InChI
InChI=1S/C23H23ClF3N5O3S/c1-31-13-14(22(33)29-16-8-15(24)9-17(10-16)30-36(2,34)35)7-20(31)21-19(25)11-18(12-28-21)32-5-3-23(26,27)4-6-32/h7-13,30H,3-6H2,1-2H3,(H,29,33)
InChIKey
AJOMVXCUXNVLIA-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Dhx9-IN-11
CAS: 2973402-91-2
CID: 169761213
Formula: C23H23ClF3N5O3S
MW: 542.0
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight542.0
XLogP33.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count9
Rotatable Bond Count6
Exact Mass541.1162230
Monoisotopic Mass541.1162230
Topological Polar Surface Area105 Ų
Heavy Atom Count36
Formal Charge0
Complexity885
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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