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Details

Stereochemistry ACHIRAL
Molecular Formula C18H14F2N8O
Molecular Weight 396.3536
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-[4,6-Diamino-2-[5-fluoro-1-[(2-fluorophenyl)methyl]-1H-pyrazolo[3,4-b]pyridin-3-yl]-5-pyrimidinyl]formamide

SMILES

NC1=NC(=NC(N)=C1NC=O)C2=NN(CC3=CC=CC=C3F)C4=C2C=C(F)C=N4

InChI

InChIKey=QTPDJMKSCMBYAC-UHFFFAOYSA-N
InChI=1S/C18H14F2N8O/c19-10-5-11-13(17-25-15(21)14(24-8-29)16(22)26-17)27-28(18(11)23-6-10)7-9-3-1-2-4-12(9)20/h1-6,8H,7H2,(H,24,29)(H4,21,22,25,26)

HIDE SMILES / InChI

Molecular Formula C18H14F2N8O
Molecular Weight 396.3536
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 21:23:30 GMT 2025
Edited
by admin
on Wed Apr 02 21:23:30 GMT 2025
Record UNII
W26MD9S6CM
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N-[4,6-Diamino-2-[5-fluoro-1-[(2-fluorophenyl)methyl]-1H-pyrazolo[3,4-b]pyridin-3-yl]-5-pyrimidinyl]formamide
Systematic Name English
Formamide, N-[4,6-diamino-2-[5-fluoro-1-[(2-fluorophenyl)methyl]-1H-pyrazolo[3,4-b]pyridin-3-yl]-5-pyrimidinyl]-
Preferred Name English
Code System Code Type Description
FDA UNII
W26MD9S6CM
Created by admin on Wed Apr 02 21:23:30 GMT 2025 , Edited by admin on Wed Apr 02 21:23:30 GMT 2025
PRIMARY
CAS
2755814-39-0
Created by admin on Wed Apr 02 21:23:30 GMT 2025 , Edited by admin on Wed Apr 02 21:23:30 GMT 2025
PRIMARY
PUBCHEM
166894658
Created by admin on Wed Apr 02 21:23:30 GMT 2025 , Edited by admin on Wed Apr 02 21:23:30 GMT 2025
PRIMARY