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Details

Stereochemistry ACHIRAL
Molecular Formula C24H24FN3O2.C6H6O3S
Molecular Weight 563.64
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of KX2-361 BESYLATE

SMILES

OS(=O)(=O)C1=CC=CC=C1.FC2=CC=CC(CNC(=O)CC3=NC=C(C=C3)C4=CC=C(C=C4)N5CCOCC5)=C2

InChI

InChIKey=PTKRPOIHIOAMPP-UHFFFAOYSA-N
InChI=1S/C24H24FN3O2.C6H6O3S/c25-21-3-1-2-18(14-21)16-27-24(29)15-22-7-4-20(17-26-22)19-5-8-23(9-6-19)28-10-12-30-13-11-28;7-10(8,9)6-4-2-1-3-5-6/h1-9,14,17H,10-13,15-16H2,(H,27,29);1-5H,(H,7,8,9)

HIDE SMILES / InChI
Molecular Formula C24H24FN3O2
Molecular Weight 405.4647
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE
Molecular Formula C6H6O3S
Molecular Weight 158.175
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Description

KX-02 is a compound demonstrating dual inhibitory activity against Src kinase and tubulin polymerization. It readily crosses the blood-brain-barrier in mice. It is under development for the treatment of solid tumors.

CNS Activity

CNS Penetrant
2554
Curator's Comment: Known to be CNS penetrant in mice. Human data not available.

Originator

Approval Year

Unknown
139594
PubMed

PubMed

TitleDatePubMed
Discovery of Novel Dual Mechanism of Action Src Signaling and Tubulin Polymerization Inhibitors (KX2-391 and KX2-361).
2018 Jun 14
Substance Class Chemical
Created
by admin
on Sat Dec 16 11:28:31 GMT 2023
Edited
by admin
on Sat Dec 16 11:28:31 GMT 2023
Record UNII
A718CYC1N0
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
KX2-361 BESYLATE
Common Name English
N-(3-FLUOROBENZYL)-2-(5-(4-MORPHOLINOPHENYL) PYRIDIN-2-YL) ACETAMIDE BESYLATE
Systematic Name English
Classification Tree Code System Code
FDA ORPHAN DRUG 413513
Created by admin on Sat Dec 16 11:28:31 GMT 2023 , Edited by admin on Sat Dec 16 11:28:31 GMT 2023
Code System Code Type Description
PUBCHEM
73334909
Created by admin on Sat Dec 16 11:28:31 GMT 2023 , Edited by admin on Sat Dec 16 11:28:31 GMT 2023
PRIMARY
CAS
1571072-87-1
Created by admin on Sat Dec 16 11:28:31 GMT 2023 , Edited by admin on Sat Dec 16 11:28:31 GMT 2023
PRIMARY
FDA UNII
A718CYC1N0
Created by admin on Sat Dec 16 11:28:31 GMT 2023 , Edited by admin on Sat Dec 16 11:28:31 GMT 2023
PRIMARY
Related Record Type Details
Structure of KX2-361
PARENT -> SALT/SOLVATE
Related Record Type Details
Structure of KX2-361
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