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

Details

Stereochemistry ACHIRAL
Molecular Formula C8H6F3N3.ClH
Molecular Weight 237.609
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BAY-H-1127 HYDROCHLORIDE

SMILES

Cl.NC1=NNC2=C1C=C(C=C2)C(F)(F)F

InChI

InChIKey=YZDVSGKEBHBBQT-UHFFFAOYSA-N
InChI=1S/C8H6F3N3.ClH/c9-8(10,11)4-1-2-6-5(3-4)7(12)14-13-6;/h1-3H,(H3,12,13,14);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 C8H6F3N3
Molecular Weight 201.1485
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 Mon Mar 31 17:35:55 GMT 2025
Edited
by admin
on Mon Mar 31 17:35:55 GMT 2025
Record UNII
S7SQ559NL8
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1H-INDAZOL-3-AMINE, 5-(TRIFLUOROMETHYL)-, MONOHYDROCHLORIDE
Preferred Name English
BAY-H-1127 HYDROCHLORIDE
Code English
1H-INDAZOL-3-AMINE, 5-(TRIFLUOROMETHYL)-, HYDROCHLORIDE (1:1)
Systematic Name English
BAY H 1127 HYDROCHLORIDE
Code English
Code System Code Type Description
FDA UNII
S7SQ559NL8
Created by admin on Mon Mar 31 17:35:55 GMT 2025 , Edited by admin on Mon Mar 31 17:35:55 GMT 2025
PRIMARY
PUBCHEM
133082857
Created by admin on Mon Mar 31 17:35:55 GMT 2025 , Edited by admin on Mon Mar 31 17:35:55 GMT 2025
PRIMARY
CAS
2250-54-6
Created by admin on Mon Mar 31 17:35:55 GMT 2025 , Edited by admin on Mon Mar 31 17:35:55 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE