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LRRK2-IN-19

CAT: 0931-T210737-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0931-T210737-01Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2839667-09-1
Target
Ligands for Target Protein for PROTAC, LRRK2
Related Pathways
PROTAC, Autophagy
Bioactivity
LRRK2-IN-19 is a PROTAC-targeted protein ligand utilized in the synthesis of PROTAC JH-XII-03-02. JH-XII-03-02 acts as an effective and selective LRRK2 PROTAC degrader, which is applicable for research in Parkinson's disease.
Smiles
N1=CN=C(C=C1C2=NNC=3C=CC(OC4(C)CC4)=CC23)N5CCNCC5
Molecular Formula
C19H22N6O
Molecular Weight
350.42
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

5-(1-methylcyclopropyl)oxy-3-(6-piperazin-1-ylpyrimidin-4-yl)-1H-indazole
CAS Number2839667-09-1
PubChem CID90398228
IUPAC Name5-(1-methylcyclopropyl)oxy-3-(6-piperazin-1-ylpyrimidin-4-yl)-1H-indazole
Molecular FormulaC19H22N6O
Molecular Weight350.4
XLogP2
Topological Polar Surface Area79
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count4
Heavy Atom Count26
Formal Charge0
Complexity494
SMILES
CC1(CC1)OC2=CC3=C(C=C2)NN=C3C4=CC(=NC=N4)N5CCNCC5
InChI
InChI=1S/C19H22N6O/c1-19(4-5-19)26-13-2-3-15-14(10-13)18(24-23-15)16-11-17(22-12-21-16)25-8-6-20-7-9-25/h2-3,10-12,20H,4-9H2,1H3,(H,23,24)
InChIKey
SYTCTBFQLWTHFY-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 5-(1-methylcyclopropyl)oxy-3-(6-piperazin-1-ylpyrimidin-4-yl)-1H-indazole
CAS: 2839667-09-1
CID: 90398228
Formula: C19H22N6O
MW: 350.4
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight350.4
XLogP32
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count4
Exact Mass350.18550935
Monoisotopic Mass350.18550935
Topological Polar Surface Area79 Ų
Heavy Atom Count26
Formal Charge0
Complexity494
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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