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TRPM7-IN-1

CAT: 0804-HY-168608-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-168608-01Size:5 mg
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Description
TRPM7-IN-1 (compound SUD), a benzoylurea derivative, is an effective TRPM7 inhibitor. TRPM7-IN-1 induces cell cycle arrest and apoptosis, decreases the migration of MCF-7 and BGC-823 cells. TRPM7-IN-1 decreases vimentin expression and increases E-cadherin expression. TRPM7-IN-1 potentially reduces the TRPM7-like current and decreases TRPM7 expression through the PI3K/Akt signaling pathway. TRPM7-IN-1 is a potential agent to suppress the metastasis of breast and gastric cancer by inhibiting TRPM7 expression and function[1].
CAS Number
1909225-07-5
UNSPSC
12352211
Target
Akt; Apoptosis; PI3K; TRP Channel
Type
Reference compound
Related Pathways
Apoptosis; Membrane Transporter/Ion Channel; Neuronal Signaling; PI3K/Akt/mTOR
Applications
Cancer-Kinase/protease
Field of Research
Cancer
Assay Protocol
https://www.medchemexpress.com/trpm7-in-1.html
Purity
98.83
Solubility
DMSO : 100 mg/mL (ultrasonic)
Smiles
O=C(NC(C1=CC=CC=C1N(C)C)=O)NC2=CC=C(OC3=NC(C)=CC(C)=N3)C(C)=C2
Molecular Formula
C23H25N5O3
Molecular Weight
419.48
References & Citations
[1]Xiaoding Zhang, et al. Novel benzoylurea derivative decreases TRPM7 channel function and inhibits cancer cells migration. Channels (Austin) . 2024 Dec;18 (1) :2396339.
Shipping Conditions
Room Temperature
Storage Conditions
-20°C, 3 years; 4°C, 2 years (Powder)
Scientific Category
Reference compound1
Clinical Information
No Development Reported
Isoform
Akt; PI3K; TRPM7

Chemical Information

Trpm7-IN-1
CAS Number1909225-07-5
PubChem CID176419325
IUPAC Name2-(dimethylamino)-N-[[4-(4,6-dimethylpyrimidin-2-yl)oxy-3-methylphenyl]carbamoyl]benzamide
Molecular FormulaC23H25N5O3
Molecular Weight419.5
XLogP4.3
Topological Polar Surface Area96.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count5
Heavy Atom Count31
Formal Charge0
Complexity606
SMILES
CC1=CC(=NC(=N1)OC2=C(C=C(C=C2)NC(=O)NC(=O)C3=CC=CC=C3N(C)C)C)C
InChI
InChI=1S/C23H25N5O3/c1-14-12-17(10-11-20(14)31-23-24-15(2)13-16(3)25-23)26-22(30)27-21(29)18-8-6-7-9-19(18)28(4)5/h6-13H,1-5H3,(H2,26,27,29,30)
InChIKey
PEHHVFAPCHRFCZ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Trpm7-IN-1
CAS: 1909225-07-5
CID: 176419325
Formula: C23H25N5O3
MW: 419.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight419.5
XLogP34.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count5
Exact Mass419.19573968
Monoisotopic Mass419.19573968
Topological Polar Surface Area96.5 Ų
Heavy Atom Count31
Formal Charge0
Complexity606
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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