3-[(2R)-2-Amino-2-phenylethyl]-5-bromo-1-[[2-fluoro-6-(trifluoromethyl)phenyl]methyl]-6-methyl-2,4(1H,3H)-pyrimidinedione hydrochloride

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C21H18BrF4N3O2.ClH
Molecular Weight	536.745
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3-[(2R)-2-Amino-2-phenylethyl]-5-bromo-1-[[2-fluoro-6-(trifluoromethyl)phenyl]methyl]-6-methyl-2,4(1H,3H)-pyrimidinedione hydrochloride

Structure Search

SMILES

Cl.CC1=C(Br)C(=O)N(C[C@H](N)C2=CC=CC=C2)C(=O)N1CC3=C(F)C=CC=C3C(F)(F)F

InChI

InChIKey=ZZTQGQNSOWFDOE-LMOVPXPDSA-N

InChI=1S/C21H18BrF4N3O2.ClH/c1-12-18(22)19(30)29(11-17(27)13-6-3-2-4-7-13)20(31)28(12)10-14-15(21(24,25)26)8-5-9-16(14)23;/h2-9,17H,10-11,27H2,1H3;1H/t17-;/m0./s1

HIDE SMILES / InChI

Approval Year

Name

Type

Language

2,4(1H,3H)-Pyrimidinedione, 3-[(2R)-2-amino-2-phenylethyl]-5-bromo-1-[[2-fluoro-6-(trifluoromethyl)phenyl]methyl]-6-methyl-, hydrochloride (1:1)

Preferred Name

English

3-[(2R)-2-Amino-2-phenylethyl]-5-bromo-1-[[2-fluoro-6-(trifluoromethyl)phenyl]methyl]-6-methyl-2,4(1H,3H)-pyrimidinedione hydrochloride

Systematic Name

English

Code System Code Type Description

FDA UNII

96ZVE4NR27

Created by admin on Wed Apr 02 14:30:56 GMT 2025 , Edited by admin on Wed Apr 02 14:30:56 GMT 2025

PRIMARY

CAS

2617827-22-0

Created by admin on Wed Apr 02 14:30:56 GMT 2025 , Edited by admin on Wed Apr 02 14:30:56 GMT 2025

PRIMARY

PUBCHEM

164522781

Created by admin on Wed Apr 02 14:30:56 GMT 2025 , Edited by admin on Wed Apr 02 14:30:56 GMT 2025

PRIMARY

PARENT (SALT/SOLVATE)


					AQ74B8XH9H

3-[(2R)-2-Amino-2-phenylethyl]-5-bromo-1-[[2-fluoro-6-(trifluoromethyl)phenyl]methyl]-6-methyl-2,4(1H,3H)-pyrimidinedione

SUBSTANCE RECORD


					96ZVE4NR27

3-[(2R)-2-Amino-2-phenylethyl]-5-bromo-1-[[2-fluoro-6-(trifluoromethyl)phenyl]methyl]-6-methyl-2,4(1H,3H)-pyrimidinedione hydrochloride