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Details

Stereochemistry ACHIRAL
Molecular Formula C21H20N4O3
Molecular Weight 376.4085
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-[2-[[4-(4-morpholinyl)phenyl]amino]-4-pyrimidinyl]benzoic acid

SMILES

OC(=O)C1=CC(=CC=C1)C2=NC(NC3=CC=C(C=C3)N4CCOCC4)=NC=C2

InChI

InChIKey=XZGAEANLPOLRDL-UHFFFAOYSA-N
InChI=1S/C21H20N4O3/c26-20(27)16-3-1-2-15(14-16)19-8-9-22-21(24-19)23-17-4-6-18(7-5-17)25-10-12-28-13-11-25/h1-9,14H,10-13H2,(H,26,27)(H,22,23,24)

HIDE SMILES / InChI

Molecular Formula C21H20N4O3
Molecular Weight 376.4085
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 20:29:01 GMT 2025
Edited
by admin
on Wed Apr 02 20:29:01 GMT 2025
Record UNII
XJ8T5U3GXW
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Benzoic acid, 3-[2-[[4-(4-morpholinyl)phenyl]amino]-4-pyrimidinyl]-
Preferred Name English
3-[2-[[4-(4-morpholinyl)phenyl]amino]-4-pyrimidinyl]benzoic acid
Systematic Name English
Code System Code Type Description
PUBCHEM
171390235
Created by admin on Wed Apr 02 20:29:01 GMT 2025 , Edited by admin on Wed Apr 02 20:29:01 GMT 2025
PRIMARY
FDA UNII
XJ8T5U3GXW
Created by admin on Wed Apr 02 20:29:01 GMT 2025 , Edited by admin on Wed Apr 02 20:29:01 GMT 2025
PRIMARY
CAS
2956125-80-5
Created by admin on Wed Apr 02 20:29:01 GMT 2025 , Edited by admin on Wed Apr 02 20:29:01 GMT 2025
PRIMARY