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Details

Stereochemistry RACEMIC
Molecular Formula C12H13N3O.ClH
Molecular Weight 251.712
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of FENYRIPOL HYDROCHLORIDE

SMILES

Cl.OC(CNC1=NC=CC=N1)C2=CC=CC=C2

InChI

InChIKey=MEDWIGMHHZRIOP-UHFFFAOYSA-N
InChI=1S/C12H13N3O.ClH/c16-11(10-5-2-1-3-6-10)9-15-12-13-7-4-8-14-12;/h1-8,11,16H,9H2,(H,13,14,15);1H

HIDE SMILES / InChI

Molecular Formula C12H13N3O
Molecular Weight 215.2511
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

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

FENYRIPOL is a skeletal muscle relaxant.

Approval Year

Patents

Patents

Sample Use Guides

In Vivo Use Guide
Curator's Comment: Toxicity data in mice.
LD50 intravenous 125 mg/kg. LD50 oral 850 mg/kg.
Route of Administration: Other
Substance Class Chemical
Created
by admin
on Fri Dec 15 14:58:51 UTC 2023
Edited
by admin
on Fri Dec 15 14:58:51 UTC 2023
Record UNII
R4I084C0NO
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
FENYRIPOL HYDROCHLORIDE
USAN  
USAN  
Official Name English
α-[(2-Pyrimidinylamino)methyl]benzyl alcohol monohydrochloride
Systematic Name English
NSC-43183
Code English
IN-836
Code English
FENYRIPOL HYDROCHLORIDE [USAN]
Common Name English
FENYRIPOL HCL
Common Name English
BENZENEMETHANOL, .ALPHA.-((2-PYRIMIDINYLAMINO)METHYL)-, MONOHYDROCHLORIDE
Common Name English
IN 836
Code English
Classification Tree Code System Code
NCI_THESAURUS C29696
Created by admin on Fri Dec 15 14:58:51 UTC 2023 , Edited by admin on Fri Dec 15 14:58:51 UTC 2023
Code System Code Type Description
PUBCHEM
17118
Created by admin on Fri Dec 15 14:58:51 UTC 2023 , Edited by admin on Fri Dec 15 14:58:51 UTC 2023
PRIMARY
ChEMBL
CHEMBL2110896
Created by admin on Fri Dec 15 14:58:51 UTC 2023 , Edited by admin on Fri Dec 15 14:58:51 UTC 2023
PRIMARY
NSC
43183
Created by admin on Fri Dec 15 14:58:51 UTC 2023 , Edited by admin on Fri Dec 15 14:58:51 UTC 2023
PRIMARY
FDA UNII
R4I084C0NO
Created by admin on Fri Dec 15 14:58:51 UTC 2023 , Edited by admin on Fri Dec 15 14:58:51 UTC 2023
PRIMARY
CAS
2441-88-5
Created by admin on Fri Dec 15 14:58:51 UTC 2023 , Edited by admin on Fri Dec 15 14:58:51 UTC 2023
PRIMARY
NCI_THESAURUS
C80984
Created by admin on Fri Dec 15 14:58:51 UTC 2023 , Edited by admin on Fri Dec 15 14:58:51 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
ENANTIOMER -> RACEMATE
ENANTIOMER -> RACEMATE
Related Record Type Details
ACTIVE MOIETY