N-Des-3-oxa-5-hydroxypentyl N-(4-(3-Oxa-5-hydroxypentyl)piperazin-1-yl)ethyl Quetiapine
Product Code
TRC-D296910-25MG
Product Format
Neat
Molecular Formula
C27 H37 N5 O2 S
Molecular Weight
495.68
Product Categories
Product Information
Chemical Data
Analyte Name
N-Des-3-oxa-5-hydroxypentyl N-(4-(3-Oxa-5-hydroxypentyl)piperazin-1-yl)ethyl Quetiapine
Molecular Formula
C27 H37 N5 O2 S
Molecular Weight
495.68
Accurate Mass
495.267
SMILES
OCCOCCN1CCN(CCN2CCN(CC2)C3=Nc4ccccc4Sc5ccccc35)CC1
InChI
InChI=1S/C27H37N5O2S/c33-20-22-34-21-19-31-13-11-29(12-14-31)9-10-30-15-17-32(18-16-30)27-23-5-1-3-7-25(23)35-26-8-4-2-6-24(26)28-27/h1-8,33H,9-22H2
IUPAC
2-[2-[4-[2-(4-benzo[b][1,4]benzothiazepin-6-ylpiperazin-1-yl)ethyl]piperazin-1-yl]ethoxy]ethanol
Product Data
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Format
Neat