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Details

Stereochemistry ACHIRAL
Molecular Formula C18H15BrF2N4O
Molecular Weight 421.239
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of AS-1669058 FREE BASE

SMILES

CC1=CC(NCCC2=CC=C[N+]([O-])=C2)=NC(=N1)C3=CC(F)=C(Br)C=C3F

InChI

InChIKey=CCHGKGFZEORIJY-UHFFFAOYSA-N
InChI=1S/C18H15BrF2N4O/c1-11-7-17(22-5-4-12-3-2-6-25(26)10-12)24-18(23-11)13-8-16(21)14(19)9-15(13)20/h2-3,6-10H,4-5H2,1H3,(H,22,23,24)

HIDE SMILES / InChI

Molecular Formula C18H15BrF2N4O
Molecular Weight 421.239
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 Mon Mar 31 21:27:51 GMT 2025
Edited
by admin
on Mon Mar 31 21:27:51 GMT 2025
Record UNII
539P83QV24
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-(4-BROMO-2,5-DIFLUOROPHENYL)-6-METHYL-N-(2-(1-OXIDOPYRIDIN-3-YL)ETHYL)PYRIMIDIN-4-AMINE
Preferred Name English
AS-1669058 FREE BASE
Common Name English
4-PYRIMIDINAMINE, 2-(4-BROMO-2,5-DIFLUOROPHENYL)-6-METHYL-N-(2-(1-OXIDO-3-PYRIDINYL)ETHYL)-
Systematic Name English
Code System Code Type Description
CAS
1395553-31-7
Created by admin on Mon Mar 31 21:27:51 GMT 2025 , Edited by admin on Mon Mar 31 21:27:51 GMT 2025
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FDA UNII
539P83QV24
Created by admin on Mon Mar 31 21:27:51 GMT 2025 , Edited by admin on Mon Mar 31 21:27:51 GMT 2025
PRIMARY
PUBCHEM
46869045
Created by admin on Mon Mar 31 21:27:51 GMT 2025 , Edited by admin on Mon Mar 31 21:27:51 GMT 2025
PRIMARY
EPA CompTox
DTXSID60161101
Created by admin on Mon Mar 31 21:27:51 GMT 2025 , Edited by admin on Mon Mar 31 21:27:51 GMT 2025
PRIMARY