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Details

Stereochemistry ACHIRAL
Molecular Formula C26H21ClFNO3
Molecular Weight 449.901
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of IKP-104

SMILES

COC1=CC(N2C(=CC(=O)C(C)=C2C3=CC=C(F)C=C3)C4=CC=CC=C4)=C(Cl)C(OC)=C1

InChI

InChIKey=MYSNSNGSKLLDBP-UHFFFAOYSA-N
InChI=1S/C26H21ClFNO3/c1-16-23(30)15-21(17-7-5-4-6-8-17)29(26(16)18-9-11-19(28)12-10-18)22-13-20(31-2)14-24(32-3)25(22)27/h4-15H,1-3H3

HIDE SMILES / InChI

Molecular Formula C26H21ClFNO3
Molecular Weight 449.901
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 Sat Dec 16 12:43:30 GMT 2023
Edited
by admin
on Sat Dec 16 12:43:30 GMT 2023
Record UNII
AL15T7WTF5
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
IKP-104
Common Name English
4(1H)-PYRIDINONE, 1-(2-CHLORO-3,5-DIMETHOXYPHENYL)-2-(4-FLUOROPHENYL)-3-METHYL-6-PHENYL-
Systematic Name English
Code System Code Type Description
PUBCHEM
130739
Created by admin on Sat Dec 16 12:43:30 GMT 2023 , Edited by admin on Sat Dec 16 12:43:30 GMT 2023
PRIMARY
EPA CompTox
DTXSID10150681
Created by admin on Sat Dec 16 12:43:30 GMT 2023 , Edited by admin on Sat Dec 16 12:43:30 GMT 2023
PRIMARY
CAS
114231-14-0
Created by admin on Sat Dec 16 12:43:30 GMT 2023 , Edited by admin on Sat Dec 16 12:43:30 GMT 2023
PRIMARY
FDA UNII
AL15T7WTF5
Created by admin on Sat Dec 16 12:43:30 GMT 2023 , Edited by admin on Sat Dec 16 12:43:30 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY
an antimitotic compound