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YH239-EE

CAT: 1410-M11502-02Size: 10 mgDry Ice: NoHazardous: No
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CAT#:1410-M11502-02Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
YH239-EE is the ethyl ester of YH239, which is a highly potent, selective MDM2-p53 antagonist with Ki of 300 nM.
CAS Number
1364488-67-4
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
504.4056
Molecular Formula
C25H27Cl2N3O4
Notes
Research use only, not for human use.
Receptor
P53/MDM2

Chemical Information

Ethyl 3-(2-(tert-butylamino)-1-(N-(4-chlorobenzyl)formamido)-2-oxoethyl)-6-chloro-1H-indole-2-carboxylate
CAS Number1364488-67-4
PubChem CID56943013
IUPAC Nameethyl 3-[2-(tert-butylamino)-1-[(4-chlorophenyl)methyl-formylamino]-2-oxoethyl]-6-chloro-1H-indole-2-carboxylate
Molecular FormulaC25H27Cl2N3O4
Molecular Weight504.4
XLogP5.2
Topological Polar Surface Area91.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count9
Heavy Atom Count34
Formal Charge0
Complexity723
SMILES
CCOC(=O)C1=C(C2=C(N1)C=C(C=C2)Cl)C(C(=O)NC(C)(C)C)N(CC3=CC=C(C=C3)Cl)C=O
InChI
InChI=1S/C25H27Cl2N3O4/c1-5-34-24(33)21-20(18-11-10-17(27)12-19(18)28-21)22(23(32)29-25(2,3)4)30(14-31)13-15-6-8-16(26)9-7-15/h6-12,14,22,28H,5,13H2,1-4H3,(H,29,32)
InChIKey
OTUBDDRFPQLPKD-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Ethyl 3-(2-(tert-butylamino)-1-(N-(4-chlorobenzyl)formamido)-2-oxoethyl)-6-chloro-1H-indole-2-carboxylate
CAS: 1364488-67-4
CID: 56943013
Formula: C25H27Cl2N3O4
MW: 504.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight504.4
XLogP35.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count9
Exact Mass503.1378617
Monoisotopic Mass503.1378617
Topological Polar Surface Area91.5 Ų
Heavy Atom Count34
Formal Charge0
Complexity723
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
B1229-25YH239-EE
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A14118-50YH239-EE 50mg
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A14118-10YH239-EE 10mg
A14118-5YH239-EE 5mg
A14118-10mM-DYH239-EE 10mM * 1mL in DMSO
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