U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C29H30N8O2
Molecular Weight 522.6009
Optical Activity NONE
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Soxataltinib

SMILES

COC1=CC=C(CN2C3CC2CN(C3)C4=CC=C(C=N4)C5=CC(=CN6N=CC(C#N)=C56)N7CC(C)(O)C7)C=N1

InChI

InChIKey=MVQAYSXDCGCOIE-UHFFFAOYSA-N
InChI=1S/C29H30N8O2/c1-29(38)17-35(18-29)22-8-25(28-21(9-30)12-33-37(28)16-22)20-4-5-26(31-11-20)34-14-23-7-24(15-34)36(23)13-19-3-6-27(39-2)32-10-19/h3-6,8,10-12,16,23-24,38H,7,13-15,17-18H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C29H30N8O2
Molecular Weight 522.6009
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 19:47:48 GMT 2025
Edited
by admin
on Wed Apr 02 19:47:48 GMT 2025
Record UNII
AZ4Q643U3D
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
soxataltinib [INN]
Preferred Name English
Soxataltinib
INN  
Official Name English
6-(3-Hydroxy-3-methyl-1-azetidinyl)-4-[6-[6-[(6-methoxy-3-pyridinyl)methyl]-3,6-diazabicyclo[3.1.1]hept-3-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile
Systematic Name English
Pyrazolo[1,5-a]pyridine-3-carbonitrile, 6-(3-hydroxy-3-methyl-1-azetidinyl)-4-[6-[6-[(6-methoxy-3-pyridinyl)methyl]-3,6-diazabicyclo[3.1.1]hept-3-yl]-3-pyridinyl]-
Systematic Name English
6-(3-hydroxy-3-methylazetidin-1-yl)-4-(6-{6-[(6-methoxypyridin-3-yl)methyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl}pyridin-3-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile
Systematic Name English
Code System Code Type Description
NCI_THESAURUS
C211756
Created by admin on Wed Apr 02 19:47:48 GMT 2025 , Edited by admin on Wed Apr 02 19:47:48 GMT 2025
PRIMARY
FDA UNII
AZ4Q643U3D
Created by admin on Wed Apr 02 19:47:48 GMT 2025 , Edited by admin on Wed Apr 02 19:47:48 GMT 2025
PRIMARY
SMS_ID
300000056634
Created by admin on Wed Apr 02 19:47:48 GMT 2025 , Edited by admin on Wed Apr 02 19:47:48 GMT 2025
PRIMARY
CAS
2546116-88-3
Created by admin on Wed Apr 02 19:47:48 GMT 2025 , Edited by admin on Wed Apr 02 19:47:48 GMT 2025
PRIMARY
INN
13087
Created by admin on Wed Apr 02 19:47:48 GMT 2025 , Edited by admin on Wed Apr 02 19:47:48 GMT 2025
PRIMARY
PUBCHEM
155296190
Created by admin on Wed Apr 02 19:47:48 GMT 2025 , Edited by admin on Wed Apr 02 19:47:48 GMT 2025
PRIMARY
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