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Details

Stereochemistry ACHIRAL
Molecular Formula C23H17F2N9
Molecular Weight 457.4382
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 2-[5-Fluoro-1-[(2-fluorophenyl)methyl]-1H-pyrazolo[3,4-b]pyridin-3-yl]-5-[(1E)-2-phenyldiazenyl]-4,6-pyrimidinediamine

SMILES

NC1=NC(=NC(N)=C1\N=N\C2=CC=CC=C2)C3=NN(CC4=C(F)C=CC=C4)C5=C3C=C(F)C=N5

InChI

InChIKey=FGVPZKOMCCRZTI-QNEJGDQOSA-N
InChI=1S/C23H17F2N9/c24-14-10-16-18(33-34(23(16)28-11-14)12-13-6-4-5-9-17(13)25)22-29-20(26)19(21(27)30-22)32-31-15-7-2-1-3-8-15/h1-11H,12H2,(H4,26,27,29,30)/b32-31+

HIDE SMILES / InChI

Approval Year

Name Type Language
2-[5-Fluoro-1-[(2-fluorophenyl)methyl]-1H-pyrazolo[3,4-b]pyridin-3-yl]-5-[(1E)-2-phenyldiazenyl]-4,6-pyrimidinediamine
Systematic Name English
2-[5-Fluoro-1-[(2-fluorophenyl)methyl]-1H-pyrazolo[3,4-b]pyridin-3-yl]-5-(2-phenyldiazenyl)-4,6-pyrimidinediamine
Preferred Name English
4,6-Pyrimidinediamine, 2-[5-fluoro-1-[(2-fluorophenyl)methyl]-1H-pyrazolo[3,4-b]pyridin-3-yl]-5-[(1E)-2-phenyldiazenyl]-
Systematic Name English
Code System Code Type Description
FDA UNII
NCX5S7ME44
Created by admin on Wed Apr 02 19:05:42 GMT 2025 , Edited by admin on Wed Apr 02 19:05:42 GMT 2025
PRIMARY
CAS
1350653-29-0
Created by admin on Wed Apr 02 19:05:42 GMT 2025 , Edited by admin on Wed Apr 02 19:05:42 GMT 2025
PRIMARY
CAS
1361570-29-7
Created by admin on Wed Apr 02 19:05:42 GMT 2025 , Edited by admin on Wed Apr 02 19:05:42 GMT 2025
NON-SPECIFIC STEREOCHEMISTRY
PUBCHEM
58065609
Created by admin on Wed Apr 02 19:05:42 GMT 2025 , Edited by admin on Wed Apr 02 19:05:42 GMT 2025
PRIMARY