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Details

Stereochemistry ACHIRAL
Molecular Formula C27H18ClF3N8
Molecular Weight 546.934
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of LUT-017

SMILES

CC1=C(NC2=C(C=CC=N2)C3=C4NC=NC4=NC=N3)C5=C(C=C1)C(NC6=CC(=C(Cl)C=C6)C(F)(F)F)=NC=C5

InChI

InChIKey=CJQQVFISHQDCLJ-UHFFFAOYSA-N
InChI=1S/C27H18ClF3N8/c1-14-4-6-17-16(8-10-33-24(17)38-15-5-7-20(28)19(11-15)27(29,30)31)21(14)39-25-18(3-2-9-32-25)22-23-26(36-12-34-22)37-13-35-23/h2-13H,1H3,(H,32,39)(H,33,38)(H,34,35,36,37)

HIDE SMILES / InChI

Molecular Formula C27H18ClF3N8
Molecular Weight 546.934
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 18:45:24 GMT 2023
Edited
by admin
on Sat Dec 16 18:45:24 GMT 2023
Record UNII
QG9RVL7D9F
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
LUT-017
Code English
1,5-Isoquinolinediamine, N1-[4-chloro-3-(trifluoromethyl)phenyl]-6-methyl-N5-[3-(9H-purin-6-yl)-2-pyridinyl]-
Systematic Name English
LUT017
Code English
Code System Code Type Description
CAS
2274819-49-5
Created by admin on Sat Dec 16 18:45:24 GMT 2023 , Edited by admin on Sat Dec 16 18:45:24 GMT 2023
PRIMARY
FDA UNII
QG9RVL7D9F
Created by admin on Sat Dec 16 18:45:24 GMT 2023 , Edited by admin on Sat Dec 16 18:45:24 GMT 2023
PRIMARY
PUBCHEM
156097095
Created by admin on Sat Dec 16 18:45:24 GMT 2023 , Edited by admin on Sat Dec 16 18:45:24 GMT 2023
PRIMARY
Related Record Type Details
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