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PROTAC c-Met degrader-2

CAT: 0931-T203391-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0931-T203391-01Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2254608-80-3
Target
C-Met/HGFR, PROTACs
Related Pathways
Tyrosine Kinase/Adaptors, PROTAC
Bioactivity
PROTACc-Met degrader-2 (PROTAC2) is a c-Met degrader developed using PROTAC technology, with a DC50 value of 50 nM.
Smiles
O=C1NC(=O)C(N2C(=O)C=3C=CC=C(OCCNC(=O)CCOCCCOCCCOC4=CC5=NC=CC(OC6=CC=C(C=C6F)NC(=O)C7(C(=O)NC8=CC=C(F)C=C8)CC7)=C5C=C4OC)C3C2=O)CC1
Molecular Formula
C51H50F2N6O13
Molecular Weight
992.97
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

PROTAC c-Met degrader-2
CAS Number2254608-80-3
PubChem CID145748083
IUPAC Name1-N'-[4-[7-[3-[3-[3-[2-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]oxyethylamino]-3-oxopropoxy]propoxy]propoxy]-6-methoxyquinolin-4-yl]oxy-3-fluorophenyl]-1-N-(4-fluorophenyl)cyclopropane-1,1-dicarboxamide
Molecular FormulaC51H50F2N6O13
Molecular Weight993.0
XLogP5
Topological Polar Surface Area239
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count16
Rotatable Bond Count24
Heavy Atom Count72
Formal Charge0
Complexity1910
SMILES
COC1=CC2=C(C=CN=C2C=C1OCCCOCCCOCCC(=O)NCCOC3=CC=CC4=C3C(=O)N(C4=O)C5CCC(=O)NC5=O)OC6=C(C=C(C=C6)NC(=O)C7(CC7)C(=O)NC8=CC=C(C=C8)F)F
InChI
InChI=1S/C51H50F2N6O13/c1-67-41-28-34-36(54-19-15-38(34)72-39-13-11-32(27-35(39)53)57-50(66)51(17-18-51)49(65)56-31-9-7-30(52)8-10-31)29-42(41)70-24-4-23-68-21-3-22-69-25-16-43(60)55-20-26-71-40-6-2-5-33-45(40)48(64)59(47(33)63)37-12-14-44(61)58-46(37)62/h2,5-11,13,15,19,27-29,37H,3-4,12,14,16-18,20-26H2,1H3,(H,55,60)(H,56,65)(H,57,66)(H,58,61,62)
InChIKey
ZAJXSUNUSHEGCB-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of PROTAC c-Met degrader-2
CAS: 2254608-80-3
CID: 145748083
Formula: C51H50F2N6O13
MW: 993.0
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight993.0
XLogP35
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count16
Rotatable Bond Count24
Exact Mass992.34039199
Monoisotopic Mass992.34039199
Topological Polar Surface Area239 Ų
Heavy Atom Count72
Formal Charge0
Complexity1910
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

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Alternative Products

CatalogName
HY-170335PROTAC c-Met degrader-2
HY-175320PROTAC c-Met degrader-5
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HY-175321PROTAC c-Met degrader-6
HY-168135-01PROTAC c-Met degrader-1
GTR19249209-01PROTAC c-Met degrader-3
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A23935-50C-02 (PROTAC HK2 Degrader-1) 50mg
A23935-10C-02 (PROTAC HK2 Degrader-1) 10mg
A23935-5C-02 (PROTAC HK2 Degrader-1) 5mg

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