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Details

Stereochemistry ACHIRAL
Molecular Formula C28H25Cl2FN4O4
Molecular Weight 571.427
Optical Activity NONE
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0
Stereo Comments Meso

SHOW SMILES / InChI
Structure of Linafexor

SMILES

FC1=CC(=CC=C1C2=NOC(=O)N2)N3[C@H]4CC[C@@H]3C[C@@H](C4)OCC5=C(ON=C5C6=C(Cl)C=CC=C6Cl)C7CC7

InChI

InChIKey=CEEANZUSISGCJL-VQFNDLOPSA-N
InChI=1S/C28H25Cl2FN4O4/c29-21-2-1-3-22(30)24(21)25-20(26(38-33-25)14-4-5-14)13-37-18-10-15-6-7-16(11-18)35(15)17-8-9-19(23(31)12-17)27-32-28(36)39-34-27/h1-3,8-9,12,14-16,18H,4-7,10-11,13H2,(H,32,34,36)/t15-,16+,18+

HIDE SMILES / InChI

Molecular Formula C28H25Cl2FN4O4
Molecular Weight 571.427
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 18:45:54 GMT 2023
Edited
by admin
on Sat Dec 16 18:45:54 GMT 2023
Record UNII
US5Q3KD5RD
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Linafexor
Common Name English
CS-0159
Code English
1,2,4-OXADIAZOL-5(2H)-ONE, 3-(4-(3-((5-CYCLOPROPYL-3-(2,6-DICHLOROPHENYL)-4-ISOXAZOLYL)METHOXY)-8-AZABICYCLO(3.2.1)OCT-8-YL)-2-FLUOROPHENYL)-
Systematic Name English
Classification Tree Code System Code
FDA ORPHAN DRUG 836821
Created by admin on Sat Dec 16 18:45:54 GMT 2023 , Edited by admin on Sat Dec 16 18:45:54 GMT 2023
Code System Code Type Description
FDA UNII
US5Q3KD5RD
Created by admin on Sat Dec 16 18:45:54 GMT 2023 , Edited by admin on Sat Dec 16 18:45:54 GMT 2023
PRIMARY
CAS
2499656-04-9
Created by admin on Sat Dec 16 18:45:54 GMT 2023 , Edited by admin on Sat Dec 16 18:45:54 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY