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

Details

Stereochemistry ACHIRAL
Molecular Formula C17H17N5O
Molecular Weight 307.3498
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of FK-3453

SMILES

CC(C)N1N=C(C=CC1=O)C2=CN=C(N)N=C2C3=CC=CC=C3

InChI

InChIKey=QECZSUGQZHURLI-UHFFFAOYSA-N
InChI=1S/C17H17N5O/c1-11(2)22-15(23)9-8-14(21-22)13-10-19-17(18)20-16(13)12-6-4-3-5-7-12/h3-11H,1-2H3,(H2,18,19,20)

HIDE SMILES / InChI

Molecular Formula C17H17N5O
Molecular Weight 307.3498
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 Sat Dec 16 14:31:14 UTC 2023
Edited
by admin
on Sat Dec 16 14:31:14 UTC 2023
Record UNII
NB2H3PD83X
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
FK-3453
Code English
6-(2-AMINO-4-PHENYLPYRIMIDIN-5-YL)-2-ISOPROPYLPYRIDAZIN-3(2H)-ONE
Common Name English
FK3453
Code English
3(2H)-PYRIDAZINONE, 6-(2-AMINO-4-PHENYL-5-PYRIMIDINYL)-2-(1-METHYLETHYL)-
Common Name English
Code System Code Type Description
FDA UNII
NB2H3PD83X
Created by admin on Sat Dec 16 14:31:14 UTC 2023 , Edited by admin on Sat Dec 16 14:31:14 UTC 2023
PRIMARY
CAS
560111-91-3
Created by admin on Sat Dec 16 14:31:14 UTC 2023 , Edited by admin on Sat Dec 16 14:31:14 UTC 2023
PRIMARY
PUBCHEM
52939114
Created by admin on Sat Dec 16 14:31:14 UTC 2023 , Edited by admin on Sat Dec 16 14:31:14 UTC 2023
PRIMARY
Related Record Type Details
TARGET -> INHIBITOR
TARGET -> INHIBITOR
METABOLIC ENZYME -> SUBSTRATE