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Details

Stereochemistry ACHIRAL
Molecular Formula C28H22Cl3N3O5
Molecular Weight 586.85
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CILOFEXOR

SMILES

OC(=O)C1=CC(=NC=C1)N2CC(O)(C2)C3=CC=C(OCC4=C(ON=C4C5=C(Cl)C=CC=C5Cl)C6CC6)C=C3Cl

InChI

InChIKey=KZSKGLFYQAYZCO-UHFFFAOYSA-N
InChI=1S/C28H22Cl3N3O5/c29-20-2-1-3-21(30)24(20)25-18(26(39-33-25)15-4-5-15)12-38-17-6-7-19(22(31)11-17)28(37)13-34(14-28)23-10-16(27(35)36)8-9-32-23/h1-3,6-11,15,37H,4-5,12-14H2,(H,35,36)

HIDE SMILES / InChI

Molecular Formula C28H22Cl3N3O5
Molecular Weight 586.85
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 Thu Jul 06 17:32:55 UTC 2023
Edited
by admin
on Thu Jul 06 17:32:55 UTC 2023
Record UNII
YUN2306954
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CILOFEXOR
INN  
Official Name English
2-(3-(2-CHLORO-4-((5-CYCLOPROPYL-3-(2,6-DICHLOROPHENYL)-4-ISOXAZOLYL)METHOXY)PHENYL)-3-HYDROXY-1-AZETIDINYL)-4-PYRIDINECARBOXYLIC ACID
Systematic Name English
PX-104
Code English
cilofexor [INN]
Common Name English
GS-9674
Code English
Cilofexor [WHO-DD]
Common Name English
PX104
Code English
4-PYRIDINECARBOXYLIC ACID, 2-(3-(2-CHLORO-4-((5-CYCLOPROPYL-3-(2,6-DICHLOROPHENYL)-4-ISOXAZOLYL)METHOXY)PHENYL)-3-HYDROXY-1-AZETIDINYL)-
Systematic Name English
Code System Code Type Description
CAS
1418274-28-8
Created by admin on Thu Jul 06 17:32:55 UTC 2023 , Edited by admin on Thu Jul 06 17:32:55 UTC 2023
PRIMARY
INN
10739
Created by admin on Thu Jul 06 17:32:55 UTC 2023 , Edited by admin on Thu Jul 06 17:32:55 UTC 2023
PRIMARY
SMS_ID
100000181101
Created by admin on Thu Jul 06 17:32:55 UTC 2023 , Edited by admin on Thu Jul 06 17:32:55 UTC 2023
PRIMARY
NCI_THESAURUS
C169848
Created by admin on Thu Jul 06 17:32:55 UTC 2023 , Edited by admin on Thu Jul 06 17:32:55 UTC 2023
PRIMARY
DRUG BANK
DB15168
Created by admin on Thu Jul 06 17:32:55 UTC 2023 , Edited by admin on Thu Jul 06 17:32:55 UTC 2023
PRIMARY
USAN
GH-103
Created by admin on Thu Jul 06 17:32:55 UTC 2023 , Edited by admin on Thu Jul 06 17:32:55 UTC 2023
PRIMARY
FDA UNII
YUN2306954
Created by admin on Thu Jul 06 17:32:55 UTC 2023 , Edited by admin on Thu Jul 06 17:32:55 UTC 2023
PRIMARY
PUBCHEM
71228883
Created by admin on Thu Jul 06 17:32:55 UTC 2023 , Edited by admin on Thu Jul 06 17:32:55 UTC 2023
PRIMARY
CAS
2163097-55-8
Created by admin on Thu Jul 06 17:32:55 UTC 2023 , Edited by admin on Thu Jul 06 17:32:55 UTC 2023
NO STRUCTURE GIVEN
Related Record Type Details
TARGET -> AGONIST
SALT/SOLVATE -> PARENT
Related Record Type Details
ACTIVE MOIETY