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WDR5-IN-6

CAT: 0804-HY-154949-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-154949-01Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
WDR5-IN-6 is a WDR5 inhibitor, targeting to WBM site. WDR5-IN-6 inhibits cell proliferation of neuroblastoma cell lines with potent anti-tumor activity. WDR5-IN-6 shows high synergy with OICR-9429 , a WDR5 inhibitor targeting to WIN site. WDR5-IN-6 can be used for reasearch in neuroblastoma[1].
CAS Number
326901-92-2
UNSPSC
12352005
Target
WDR5
Type
Reference compound
Related Pathways
Epigenetics
Applications
Cancer-programmed cell death
Field of Research
Cancer
Assay Protocol
https://www.medchemexpress.com/wdr5-in-6.html
Purity
99.83
Solubility
DMSO : 100 mg/mL (ultrasonic)
Smiles
O=S(C1=CC(Cl)=CC=C1Cl)(N2C=NC3=C2C=CC=C3)=O
Molecular Formula
C13H8Cl2N2O2S
Molecular Weight
327.19
References & Citations
[1]Han QL, et al. Discovery, evaluation and mechanism study of WDR5-targeted small molecular inhibitors for neuroblastoma. Acta Pharmacol Sin. 2023 Apr;44 (4) :877-887.
Shipping Conditions
Blue Ice
Storage Conditions
-20°C, 3 years (Powder)
Scientific Category
Reference compound1
Clinical Information
No Development Reported

Chemical Information

1-((2,5-Dichlorophenyl)sulfonyl)-1H-benzimidazole
CAS Number326901-92-2
PubChem CID684718
IUPAC Name1-(2,5-dichlorophenyl)sulfonylbenzimidazole
Molecular FormulaC13H8Cl2N2O2S
Molecular Weight327.2
XLogP3.9
Topological Polar Surface Area60.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count20
Formal Charge0
Complexity454
SMILES
C1=CC=C2C(=C1)N=CN2S(=O)(=O)C3=C(C=CC(=C3)Cl)Cl
InChI
InChI=1S/C13H8Cl2N2O2S/c14-9-5-6-10(15)13(7-9)20(18,19)17-8-16-11-3-1-2-4-12(11)17/h1-8H
InChIKey
PXUHMEZESKEPKJ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-((2,5-Dichlorophenyl)sulfonyl)-1H-benzimidazole
CAS: 326901-92-2
CID: 684718
Formula: C13H8Cl2N2O2S
MW: 327.2
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight327.2
XLogP33.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass325.9683541
Monoisotopic Mass325.9683541
Topological Polar Surface Area60.3 Ų
Heavy Atom Count20
Formal Charge0
Complexity454
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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