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Details

Stereochemistry ACHIRAL
Molecular Formula C24H20BrClN2O
Molecular Weight 467.785
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of L-168049

SMILES

CCCOC1=CC=C(Br)C=C1C2=C(NC(=C2)C3=CC=C(Cl)C=C3)C4=CC=NC=C4

InChI

InChIKey=HHBOWXZOLYQFNY-UHFFFAOYSA-N
InChI=1S/C24H20BrClN2O/c1-2-13-29-23-8-5-18(25)14-20(23)21-15-22(16-3-6-19(26)7-4-16)28-24(21)17-9-11-27-12-10-17/h3-12,14-15,28H,2,13H2,1H3

HIDE SMILES / InChI

Molecular Formula C24H20BrClN2O
Molecular Weight 467.785
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Targets

Targets

Primary TargetPharmacologyConditionPotency
7.0 nM [IC50]
Substance Class Chemical
Created
by admin
on Sat Dec 16 09:23:18 GMT 2023
Edited
by admin
on Sat Dec 16 09:23:18 GMT 2023
Record UNII
TY8UDT6Z37
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
L-168049
Code English
PYRIDINE, 4-(3-(5-BROMO-2-PROPOXYPHENYL)-5-(4-CHLOROPHENYL)-1H-PYRROL-2-YL)-
Systematic Name English
4-(3-(5-BROMO-2-PROPOXYPHENYL)-5-(4-CHLOROPHENYL)-1H-PYRROL-2-YL)PYRIDINE
Systematic Name English
Code System Code Type Description
CAS
191034-25-0
Created by admin on Sat Dec 16 09:23:18 GMT 2023 , Edited by admin on Sat Dec 16 09:23:18 GMT 2023
PRIMARY
EPA CompTox
DTXSID10415520
Created by admin on Sat Dec 16 09:23:18 GMT 2023 , Edited by admin on Sat Dec 16 09:23:18 GMT 2023
PRIMARY
FDA UNII
TY8UDT6Z37
Created by admin on Sat Dec 16 09:23:18 GMT 2023 , Edited by admin on Sat Dec 16 09:23:18 GMT 2023
PRIMARY
PUBCHEM
5311276
Created by admin on Sat Dec 16 09:23:18 GMT 2023 , Edited by admin on Sat Dec 16 09:23:18 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY