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Details

Stereochemistry ACHIRAL
Molecular Formula C23H20F3N5O2
Molecular Weight 455.4324
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Redafamdastat

SMILES

FC(F)(F)C1=CN=C(OC2=CC(C=C3CCN(CC3)C(=O)NC4=NN=CC=C4)=CC=C2)C=C1

InChI

InChIKey=BATCTBJIJJEPHM-UHFFFAOYSA-N
InChI=1S/C23H20F3N5O2/c24-23(25,26)18-6-7-21(27-15-18)33-19-4-1-3-17(14-19)13-16-8-11-31(12-9-16)22(32)29-20-5-2-10-28-30-20/h1-7,10,13-15H,8-9,11-12H2,(H,29,30,32)

HIDE SMILES / InChI

Molecular Formula C23H20F3N5O2
Molecular Weight 455.4324
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 03:07:40 UTC 2023
Edited
by admin
on Sat Dec 16 03:07:40 UTC 2023
Record UNII
H4C81M8YYW
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Redafamdastat
Common Name English
PF-4457845
Code English
redafamdastat [INN]
Common Name English
N-3-Pyridazinyl-4-[[3-[[5-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]methylene]-1-piperidinecarboxamide
Systematic Name English
PF-04457845
Code English
1-Piperidinecarboxamide, N-3-pyridazinyl-4-[[3-[[5-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]methylene]-
Systematic Name English
Code System Code Type Description
CAS
1020315-31-4
Created by admin on Sat Dec 16 03:07:40 UTC 2023 , Edited by admin on Sat Dec 16 03:07:40 UTC 2023
PRIMARY
PUBCHEM
24771824
Created by admin on Sat Dec 16 03:07:40 UTC 2023 , Edited by admin on Sat Dec 16 03:07:40 UTC 2023
PRIMARY
WIKIPEDIA
PF-04457845
Created by admin on Sat Dec 16 03:07:40 UTC 2023 , Edited by admin on Sat Dec 16 03:07:40 UTC 2023
PRIMARY
EPA CompTox
DTXSID00144539
Created by admin on Sat Dec 16 03:07:40 UTC 2023 , Edited by admin on Sat Dec 16 03:07:40 UTC 2023
PRIMARY
SMS_ID
300000032092
Created by admin on Sat Dec 16 03:07:40 UTC 2023 , Edited by admin on Sat Dec 16 03:07:40 UTC 2023
PRIMARY
INN
12589
Created by admin on Sat Dec 16 03:07:40 UTC 2023 , Edited by admin on Sat Dec 16 03:07:40 UTC 2023
PRIMARY
DRUG BANK
DB12012
Created by admin on Sat Dec 16 03:07:40 UTC 2023 , Edited by admin on Sat Dec 16 03:07:40 UTC 2023
PRIMARY
FDA UNII
H4C81M8YYW
Created by admin on Sat Dec 16 03:07:40 UTC 2023 , Edited by admin on Sat Dec 16 03:07:40 UTC 2023
PRIMARY
Related Record Type Details
TARGET -> INHIBITOR
IRREVERSIBLE INHIBITOR
IC50
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ACTIVE MOIETY