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

Details

Stereochemistry ACHIRAL
Molecular Formula C23H21FN4O2.2ClH
Molecular Weight 477.359
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ALB-127158 dihydrochloride

SMILES

Cl.Cl.CN1C2=C(CNCC2)C3=C1C=C(C=C3)N4C=CC(OCC5=CC=C(F)C=N5)=CC4=O

InChI

InChIKey=GYHXZTCAPJTLCW-UHFFFAOYSA-N
InChI=1S/C23H21FN4O2.2ClH/c1-27-21-6-8-25-13-20(21)19-5-4-17(10-22(19)27)28-9-7-18(11-23(28)29)30-14-16-3-2-15(24)12-26-16;;/h2-5,7,9-12,25H,6,8,13-14H2,1H3;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 C23H21FN4O2
Molecular Weight 404.4368
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 19:48:38 GMT 2025
Edited
by admin
on Wed Apr 02 19:48:38 GMT 2025
Record UNII
SPC9CAL5R5
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ALB-127158 dihydrochloride
Code English
ALB 127158(a) dihydrochloride
Preferred Name English
ALB-127158(A)
Code English
2(1H)-Pyridinone, 4-[(5-fluoro-2-pyridinyl)methoxy]-1-(2,3,4,5-tetrahydro-5-methyl-1H-pyrido[4,3-b]indol-7-yl)-, hydrochloride (1:2)
Systematic Name English
Code System Code Type Description
CAS
1173152-24-3
Created by admin on Wed Apr 02 19:48:39 GMT 2025 , Edited by admin on Wed Apr 02 19:48:39 GMT 2025
PRIMARY
FDA UNII
SPC9CAL5R5
Created by admin on Wed Apr 02 19:48:39 GMT 2025 , Edited by admin on Wed Apr 02 19:48:39 GMT 2025
PRIMARY
PUBCHEM
68658066
Created by admin on Wed Apr 02 19:48:39 GMT 2025 , Edited by admin on Wed Apr 02 19:48:39 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
Related Record Type Details
ACTIVE MOIETY