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MRT68921

CAT: 0013-GTR19167974-01Size: 2 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19167974-01Size:2 mg
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Description
MRT68921 is a potent dual inhibitor of the autophagy-initiating kinases ULK1 and ULK2, exhibiting IC50 values of 2.9 nM and 1.1 nM, respectively. This compound is a valuable research tool for investigating autophagy mechanisms and has been utilized in both cellular and in vivo studies to probe autophagy-dependent processes in cancer and other diseases.
CAS Number
1190379-70-4
Product Name Alternative
MRT 68921, MRT-68921, MRT68921, ULK, ULK1, ULK2, Unc-51 like kinase
Field of Research
Cell Biology
Purity
98.00% (May vary between batches)
Solubility
H2O:< 1 mg/mL (insoluble or slightly soluble) ; DMSO:10 mg/mL (23.01 mM) ; Ethanol:< 1 mg/mL (insoluble or slightly soluble) ;10% DMSO+40% PEG300+5% Tween 80+45% Saline:1 mg/mL (2.3 mM)
Smiles
N (CCCNC (=O) C1CCC1) C=2C (=CN=C (NC=3C=C4C (=CC3) CN (C) CC4) N2) C5CC5
Molecular Formula
C25H34N6O
Molecular Weight
434.58
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

N-(3-((5-Cyclopropyl-2-((2-methyl-1,2,3,4-tetrahydroisoquinolin-6-yl)amino)pyrimidin-4-yl)amino)propyl)cyclobutanecarboxamide
CAS Number1190379-70-4
PubChem CID59225335
IUPAC NameN-[3-[[5-cyclopropyl-2-[(2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)amino]pyrimidin-4-yl]amino]propyl]cyclobutanecarboxamide
Molecular FormulaC25H34N6O
Molecular Weight434.6
XLogP4.4
Topological Polar Surface Area82.2
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count9
Heavy Atom Count32
Formal Charge0
Complexity624
SMILES
CN1CCC2=C(C1)C=CC(=C2)NC3=NC=C(C(=N3)NCCCNC(=O)C4CCC4)C5CC5
InChI
InChI=1S/C25H34N6O/c1-31-13-10-19-14-21(9-8-20(19)16-31)29-25-28-15-22(17-6-7-17)23(30-25)26-11-3-12-27-24(32)18-4-2-5-18/h8-9,14-15,17-18H,2-7,10-13,16H2,1H3,(H,27,32)(H2,26,28,29,30)
InChIKey
KKISLZKMBSCLSS-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-(3-((5-Cyclopropyl-2-((2-methyl-1,2,3,4-tetrahydroisoquinolin-6-yl)amino)pyrimidin-4-yl)amino)propyl)cyclobutanecarboxamide
CAS: 1190379-70-4
CID: 59225335
Formula: C25H34N6O
MW: 434.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight434.6
XLogP34.4
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count9
Exact Mass434.27940973
Monoisotopic Mass434.27940973
Topological Polar Surface Area82.2 Ų
Heavy Atom Count32
Formal Charge0
Complexity624
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

Alternative Products

CatalogName
BUP05833-01MRT68921
T5356-01MRT68921 HCl
HY-100006A-01MRT68921 (dihydrochloride)
MBS3846077-01MRT68921 dihydrochloride
A15880-5MRT68921 5mg
HY-100006BMRT68921 (hydrochloride)
A15880-50MRT68921 50mg
A15880-25MRT68921 25mg

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