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Details

Stereochemistry ACHIRAL
Molecular Formula C29H20Cl2N2O5
Molecular Weight 547.386
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Danifexor

SMILES

OC(=O)C1=CC=C(OC2=CC3=C(C=C2)C=C(OCC4=C(ON=C4C5=C(Cl)C=CC=C5Cl)C6CC6)C=C3)N=C1

InChI

InChIKey=CQQYMDWPAWAMPJ-UHFFFAOYSA-N
InChI=1S/C29H20Cl2N2O5/c30-23-2-1-3-24(31)26(23)27-22(28(38-33-27)16-4-5-16)15-36-20-9-6-18-13-21(10-7-17(18)12-20)37-25-11-8-19(14-32-25)29(34)35/h1-3,6-14,16H,4-5,15H2,(H,34,35)

HIDE SMILES / InChI

Molecular Formula C29H20Cl2N2O5
Molecular Weight 547.386
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 08:03:07 GMT 2025
Edited
by admin
on Wed Apr 02 08:03:07 GMT 2025
Record UNII
TUU8G1CX9O
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1<sup>2</sup>,1<sup>6</sup>-dichloro-2<sup>5</sup>-cyclopropyl-4,6-dioxa-7(2)-pyridina-2(3,4)-[1,2]oxazola-5(2,6)-naphthalena-1(1)-benzenaheptaphane-7<sup>5</sup>-carboxylic acid
Preferred Name English
Danifexor
INN  
Official Name English
danifexor [INN]
Common Name English
3-Pyridinecarboxylic acid, 6-[[6-[[5-cyclopropyl-3-(2,6-dichlorophenyl)-4-isoxazolyl]methoxy]-2-naphthalenyl]oxy]-
Systematic Name English
Code System Code Type Description
FDA UNII
TUU8G1CX9O
Created by admin on Wed Apr 02 08:03:07 GMT 2025 , Edited by admin on Wed Apr 02 08:03:07 GMT 2025
PRIMARY
CAS
2648738-68-3
Created by admin on Wed Apr 02 08:03:07 GMT 2025 , Edited by admin on Wed Apr 02 08:03:07 GMT 2025
PRIMARY
PUBCHEM
156455076
Created by admin on Wed Apr 02 08:03:07 GMT 2025 , Edited by admin on Wed Apr 02 08:03:07 GMT 2025
PRIMARY
INN
13339
Created by admin on Wed Apr 02 08:03:07 GMT 2025 , Edited by admin on Wed Apr 02 08:03:07 GMT 2025
PRIMARY
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ACTIVE MOIETY