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Details

Stereochemistry ACHIRAL
Molecular Formula C17H14F2N8
Molecular Weight 368.3435
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-[5-Fluoro-1-(2-fluorobenzyl)-1 H-pyrazolo[3,4-b]pyridin-3-yl]pyrimidine-4,5,6-triamine

SMILES

NC1=NC(=NC(N)=C1N)C2=NN(CC3=CC=CC=C3F)C4=C2C=C(F)C=N4

InChI

InChIKey=DVTLORLSDKRODH-UHFFFAOYSA-N
InChI=1S/C17H14F2N8/c18-9-5-10-13(16-24-14(21)12(20)15(22)25-16)26-27(17(10)23-6-9)7-8-3-1-2-4-11(8)19/h1-6H,7,20H2,(H4,21,22,24,25)

HIDE SMILES / InChI

Molecular Formula C17H14F2N8
Molecular Weight 368.3435
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 21:23:31 GMT 2025
Edited
by admin
on Wed Apr 02 21:23:31 GMT 2025
Record UNII
585N4V8YU4
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-[5-Fluoro-1-(2-fluorobenzyl)-1H-pyrazolo[3,4-b]pyridin-3-yl]pyrimidine-4,5,6-triamine
Preferred Name English
2-[5-Fluoro-1-(2-fluorobenzyl)-1 H-pyrazolo[3,4-b]pyridin-3-yl]pyrimidine-4,5,6-triamine
Systematic Name English
2-[5-Fluoro-1-[(2-fluorophenyl)methyl]-1H-pyrazolo[3,4-b]pyridin-3-yl]-4,5,6-pyrimidinetriamine
Systematic Name English
4,5,6-Pyrimidinetriamine, 2-[5-fluoro-1-[(2-fluorophenyl)methyl]-1H-pyrazolo[3,4-b]pyridin-3-yl]-
Systematic Name English
Code System Code Type Description
FDA UNII
585N4V8YU4
Created by admin on Wed Apr 02 21:23:31 GMT 2025 , Edited by admin on Wed Apr 02 21:23:31 GMT 2025
PRIMARY
CAS
1350653-30-3
Created by admin on Wed Apr 02 21:23:31 GMT 2025 , Edited by admin on Wed Apr 02 21:23:31 GMT 2025
PRIMARY
PUBCHEM
58065603
Created by admin on Wed Apr 02 21:23:31 GMT 2025 , Edited by admin on Wed Apr 02 21:23:31 GMT 2025
PRIMARY