Brexpiprazole Impurity , 90%+ , 2116542-21-1

CAS NO.：2116542-21-1

Empirical Formula: C38H40N4O4S

Molecular Weight: 648.81

MDL number: MFCD31421114

Update time: 2023-04-23

PRODUCT Properties

Melting point:	>80°C (dec.)
Boiling point:	867.1±65.0 °C(Predicted)
Density	1.254±0.06 g/cm3(Predicted)
storage temp.	Refrigerator
solubility	DMSO (Slightly), Methanol (Heated, Slightly)
pka	11.21±0.70(Predicted)
form	Solid
color	Light Brown to Orange
InChIKey	KVKIZAUWWJSARG-UHFFFAOYSA-N
SMILES	N1C2=C(C=CC(OCCCCOC3C=CC4C(N=3)=CC(OCCCCN3CCN(C5=C6C=CSC6=CC=C5)CC3)=CC=4)=C2)C=CC1=O

Description and Uses

O-[4-((2-Oxo-1,2-dihydroquinolin-7-yl)oxy)butyl] Brexpiprazole is a derivative of Brexpiprazole (B677385) which is a drug candidate useful in treatment and prevention of mental disorders including CNS disorders.

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