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EPZ020411 HCl

CAT: 0931-T69922-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0931-T69922-01Size:25 mg
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CAS Number
2095432-47-4
Target
Others
Related Pathways
Others
Bioactivity
EPZ020411 is a potent and selective PRMT6 inhibitor tool compound. EPZ020411 shows good bioavailability following subcutaneous dosing in rats making it a suitable tool for in vivo studies. EPZ020411 suppresses RCC1 arginine methylation and improves the cytotoxic activity of radiotherapy against GSC brain tumor xenografts.
Smiles
C(N(CCNC)C)C=1C(=NNC1)C2=CC=C(O[C@H]3C[C@H](OCCC4CCOCC4)C3)C=C2.Cl.Cl
Molecular Formula
C25H40Cl2N4O3
Molecular Weight
515.52
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

EPZ020411 Dihydrochloride
CAS Number2095432-47-4
PubChem CID129896715
IUPAC NameN,N'-dimethyl-N'-[[5-[4-[3-[2-(oxan-4-yl)ethoxy]cyclobutyl]oxyphenyl]-1H-pyrazol-4-yl]methyl]ethane-1,2-diamine;dihydrochloride
Molecular FormulaC25H40Cl2N4O3
Molecular Weight515.5
Topological Polar Surface Area71.6
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count6
Rotatable Bond Count12
Heavy Atom Count34
Formal Charge0
Complexity519
SMILES
CNCCN(C)CC1=C(NN=C1)C2=CC=C(C=C2)OC3CC(C3)OCCC4CCOCC4.Cl.Cl
InChI
InChI=1S/C25H38N4O3.2ClH/c1-26-10-11-29(2)18-21-17-27-28-25(21)20-3-5-22(6-4-20)32-24-15-23(16-24)31-14-9-19-7-12-30-13-8-19;;/h3-6,17,19,23-24,26H,7-16,18H2,1-2H3,(H,27,28);2*1H
InChIKey
QCHZLIPYCYHFLI-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of EPZ020411 Dihydrochloride
CAS: 2095432-47-4
CID: 129896715
Formula: C25H40Cl2N4O3
MW: 515.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight515.5
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count6
Rotatable Bond Count12
Exact Mass514.2477465
Monoisotopic Mass514.2477465
Topological Polar Surface Area71.6 Ų
Heavy Atom Count34
Formal Charge0
Complexity519
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count3
Compound Is CanonicalizedYes

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