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XST-14

CAT: 0957-E1750-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0957-E1750-01Size:5 mg
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Description
XST-14 is a potent, competitive, and highly selective inhibitor of ULK1 and exhibits an IC50 of 26.6 nM in an in vitro ULK1 kinase activity assay, respectively. XST-14 reduces the phosphorylation of the ULK1 downstream substrate and induces autophagy inhibition. It exhibits antitumor effects.
CAS Number
2607143-50-8
Target
ULK
Activity
Autophagy
Molecular Formula
C16H21NO4

Chemical Information

Methyl 4,6-diisopropoxy-1H-indole-2-carboxylate
CAS Number2607143-50-8
PubChem CID155291452
IUPAC Namemethyl 4,6-di(propan-2-yloxy)-1H-indole-2-carboxylate
Molecular FormulaC16H21NO4
Molecular Weight291.34
XLogP3.8
Topological Polar Surface Area60.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count6
Heavy Atom Count21
Formal Charge0
Complexity358
SMILES
CC(C)OC1=CC2=C(C=C(N2)C(=O)OC)C(=C1)OC(C)C
InChI
InChI=1S/C16H21NO4/c1-9(2)20-11-6-13-12(15(7-11)21-10(3)4)8-14(17-13)16(18)19-5/h6-10,17H,1-5H3
InChIKey
ZNFMBFABCSHXPM-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Methyl 4,6-diisopropoxy-1H-indole-2-carboxylate
CAS: 2607143-50-8
CID: 155291452
Formula: C16H21NO4
MW: 291.34
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight291.34
XLogP33.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count6
Exact Mass291.14705815
Monoisotopic Mass291.14705815
Topological Polar Surface Area60.6 Ų
Heavy Atom Count21
Formal Charge0
Complexity358
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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Alternative Products

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