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Details

Stereochemistry ACHIRAL
Molecular Formula C21H23Cl2N5O
Molecular Weight 432.346
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of RG-3039 FREE BASE

SMILES

NC1=NC2=C(C(N)=N1)C(OCC3CCN(CC4=C(Cl)C=CC=C4Cl)CC3)=CC=C2

InChI

InChIKey=MNLHFGXIUJNDAF-UHFFFAOYSA-N
InChI=1S/C21H23Cl2N5O/c22-15-3-1-4-16(23)14(15)11-28-9-7-13(8-10-28)12-29-18-6-2-5-17-19(18)20(24)27-21(25)26-17/h1-6,13H,7-12H2,(H4,24,25,26,27)

HIDE SMILES / InChI

Molecular Formula C21H23Cl2N5O
Molecular Weight 432.346
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 Fri Dec 15 19:48:00 UTC 2023
Edited
by admin
on Fri Dec 15 19:48:00 UTC 2023
Record UNII
KSV93L7URW
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
RG-3039 FREE BASE
Code English
5-(1-(2,6-DICHLOROBENZYL)-PIPERIDIN-4-YL)METHOXYQUINAZOLINE-2,4-DIAMINE
Systematic Name English
D-157495
Common Name English
PF-06687859
Code English
D157495
Code English
2,4-QUINAZOLINEDIAMINE, 5-((1-((2,6-DICHLOROPHENYL)METHYL)-4-PIPERIDINYL)METHOXY)-
Systematic Name English
Classification Tree Code System Code
FDA ORPHAN DRUG 289509
Created by admin on Fri Dec 15 19:48:00 UTC 2023 , Edited by admin on Fri Dec 15 19:48:00 UTC 2023
Code System Code Type Description
EPA CompTox
DTXSID00143380
Created by admin on Fri Dec 15 19:48:00 UTC 2023 , Edited by admin on Fri Dec 15 19:48:00 UTC 2023
PRIMARY
CAS
1005504-62-0
Created by admin on Fri Dec 15 19:48:00 UTC 2023 , Edited by admin on Fri Dec 15 19:48:00 UTC 2023
PRIMARY
FDA UNII
KSV93L7URW
Created by admin on Fri Dec 15 19:48:00 UTC 2023 , Edited by admin on Fri Dec 15 19:48:00 UTC 2023
PRIMARY
PUBCHEM
53258905
Created by admin on Fri Dec 15 19:48:00 UTC 2023 , Edited by admin on Fri Dec 15 19:48:00 UTC 2023
PRIMARY
SMS_ID
100000181829
Created by admin on Fri Dec 15 19:48:00 UTC 2023 , Edited by admin on Fri Dec 15 19:48:00 UTC 2023
PRIMARY
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