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Details

Stereochemistry ACHIRAL
Molecular Formula C20H14ClF2NO5S
Molecular Weight 453.844
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of NDI-091143

SMILES

COC(=O)C1=CC(Cl)=C(O)C(=C1)S(=O)(=O)NC2=C(F)C=C(F)C(=C2)C3=CC=CC=C3

InChI

InChIKey=YSTSHUWHIDBZAK-UHFFFAOYSA-N
InChI=1S/C20H14ClF2NO5S/c1-29-20(26)12-7-14(21)19(25)18(8-12)30(27,28)24-17-9-13(15(22)10-16(17)23)11-5-3-2-4-6-11/h2-10,24-25H,1H3

HIDE SMILES / InChI

Molecular Formula C20H14ClF2NO5S
Molecular Weight 453.844
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 18:45:15 GMT 2025
Edited
by admin
on Wed Apr 02 18:45:15 GMT 2025
Record UNII
P867JW2Q2J
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NDI-091143
Code English
NDI091143
Preferred Name English
Benzoic acid, 3-chloro-5-[[(4,6-difluoro[1,1?-biphenyl]-3-yl)amino]sulfonyl]-4-hydroxy-, methyl ester
Systematic Name English
Methyl 3-chloro-5-[[(4,6-difluoro[1,1?-biphenyl]-3-yl)amino]sulfonyl]-4-hydroxybenzoate
Systematic Name English
Methyl 3-chloro-5-[(2,4-difluoro-5-phenylphenyl)sulfamoyl]-4-hydroxybenzoate
Systematic Name English
Code System Code Type Description
CAS
2375840-87-0
Created by admin on Wed Apr 02 18:45:15 GMT 2025 , Edited by admin on Wed Apr 02 18:45:15 GMT 2025
PRIMARY
FDA UNII
P867JW2Q2J
Created by admin on Wed Apr 02 18:45:15 GMT 2025 , Edited by admin on Wed Apr 02 18:45:15 GMT 2025
PRIMARY
PUBCHEM
137796782
Created by admin on Wed Apr 02 18:45:15 GMT 2025 , Edited by admin on Wed Apr 02 18:45:15 GMT 2025
PRIMARY
Related Record Type Details
TARGET -> INHIBITOR
Half life in Human liver microsomes only 3.36 minutes.
ALLOSTERIC
IC50
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ACTIVE MOIETY