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Racecadotril-[d5]

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General Information
Catalog: BLP-004072
CAS: 1246815-11-1
Molecular Formula: C21H18D5NO4S
Molecular Weight: 390.51

Chemical Structure

Description	Racecadotril-[d5] is a labelled compound of Racecadotril. Racecadotril is a peripherally acting enkephalinase inhibitor with an IC50 of 4.5 μM.
Synonyms	N-[2-[(Acetylthio)methyl]-1-oxo-3-phenylpropyl]glycine (Phenyl-d5)methyl Ester; Acetorphan-d5; (+/-)-Racecadotril-d5; Redotil-d5; Tiorfan-d5
IUPAC Name	(2,3,4,5,6-pentadeuteriophenyl)methyl 2-[[2-(acetylsulfanylmethyl)-3-phenylpropanoyl]amino]acetate
Related CAS	81110-73-8 (unlabelled)
Canonical SMILES	CC(=O)SCC(CC1=CC=CC=C1)C(=O)NCC(=O)OCC2=CC=CC=C2
InChI	InChI=1S/C21H23NO4S/c1-16(23)27-15-19(12-17-8-4-2-5-9-17)21(25)22-13-20(24)26-14-18-10-6-3-7-11-18/h2-11,19H,12-15H2,1H3,(H,22,25)/i3D,6D,7D,10D,11D
InChI Key	ODUOJXZPIYUATO-LKOJFEAXSA-N
Boiling Point	574.5±50.0°C at 760 mmHg
Melting Point	77-79°C
Purity	98%
Density	1.2±0.1 g/cm3
Solubility	Soluble in DMSO (Slightly), Ethyl Acetate (Slightly)
Appearance	White Solid
Storage	Store at 2-8°C