U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C19H25N3O3.2ClH
Molecular Weight 416.342
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of AMELPARIB DIHYDROCHLORIDE

SMILES

Cl.Cl.CCOC1=CC(CN2CCOCC2)=CC3=C1C4=C(CCCN4)C(=O)N3

InChI

InChIKey=GJWOWHCCGXTLDV-UHFFFAOYSA-N
InChI=1S/C19H25N3O3.2ClH/c1-2-25-16-11-13(12-22-6-8-24-9-7-22)10-15-17(16)18-14(19(23)21-15)4-3-5-20-18;;/h10-11,20H,2-9,12H2,1H3,(H,21,23);2*1H

HIDE SMILES / InChI

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C19H25N3O3
Molecular Weight 343.4201
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 13:29:07 GMT 2025
Edited
by admin
on Wed Apr 02 13:29:07 GMT 2025
Record UNII
65QTK866EC
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Benzo[h]-1,6-naphthyridin-5(1H)-one, 10-ethoxy-2,3,4,6-tetrahydro-8-(4-morpholinylmethyl)-, hydrochloride (1:2)
Preferred Name English
AMELPARIB DIHYDROCHLORIDE
Common Name English
Code System Code Type Description
CAS
1227156-71-9
Created by admin on Wed Apr 02 13:29:07 GMT 2025 , Edited by admin on Wed Apr 02 13:29:07 GMT 2025
PRIMARY
PUBCHEM
67381129
Created by admin on Wed Apr 02 13:29:07 GMT 2025 , Edited by admin on Wed Apr 02 13:29:07 GMT 2025
PRIMARY
FDA UNII
65QTK866EC
Created by admin on Wed Apr 02 13:29:07 GMT 2025 , Edited by admin on Wed Apr 02 13:29:07 GMT 2025
PRIMARY
Related Record Type Details
SOLVATE->ANHYDROUS
PARENT -> SALT/SOLVATE
Related Record Type Details
ACTIVE MOIETY