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ChemicalBook >> CAS DataBase List >>11-(PIPERAZIN-1-YL)DIBENZO[B,F][1,4]THIAZEPINE

11-(PIPERAZIN-1-YL)DIBENZO[B,F][1,4]THIAZEPINE

CAS No.
5747-48-8
Chemical Name:
11-(PIPERAZIN-1-YL)DIBENZO[B,F][1,4]THIAZEPINE
Synonyms
Norquetiapine;N-Desalkylquetiapine;11-(Piperazin-1-yl);Norquetiapine (Standard);2-(Piperazin-1-yl)dithiazepin;11-Piperazinodibenzo[b,f][1,4]thiazepine;N-Des[2-(2-hydroxyethoxy)ethyl] Quetiapine;6-piperazin-1-ylbenzo[b][1,4]benzothiazepine;11-(1-Piperazinyl)-dibenzo[b,f][1,4]thiazepine;11-(piperazin-1-yl)dibenzo[b,f][1,4]thiazepine
CBNumber:
CB81176568
Molecular Formula:
C17H17N3S
Molecular Weight:
295.4
MDL Number:
MFCD09835366
MOL File:
5747-48-8.mol
MSDS File:
SDS
Last updated:2026-05-28 03:02:16
Product description Number Pack Size Price
Norquetiapine ≥98% 36687 10mg $85
Norquetiapine ≥98% 36687 25mg $202
Norquetiapine ≥98% 36687 50mg $358
Norquetiapine ≥98% 36687 100mg $673
11-Piperazin-1-yl-dibenzo[b,f][1,4]thiazepine 292235 500mg $566
More product size

11-(PIPERAZIN-1-YL)DIBENZO[B,F][1,4]THIAZEPINE Properties

Boiling point 465.2±55.0 °C(Predicted)
Density 1.30
storage temp. Keep in dark place,Inert atmosphere,Store in freezer, under -20°C
solubility DMF: 16 mg/mL; DMSO: 3 mg/mL; Ethanol: 5 mg/mL; PBS (pH 7.2): 0.25 mg/mL
form A solid
pka 8.55±0.10(Predicted)
FDA UNII V3H1ZVV9S6

SAFETY

Risk and Safety Statements

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H302-H312-H332
Precautionary statements  P280
HazardClass  IRRITANT
NFPA 704
0
2 0

11-(PIPERAZIN-1-YL)DIBENZO[B,F][1,4]THIAZEPINE price More Price(88)

Manufacturer Product number Product description CAS number Packaging Price Updated Buy
Cayman Chemical 36687 Norquetiapine ≥98% 5747-48-8 10mg $85 2026-04-30 Buy
Cayman Chemical 36687 Norquetiapine ≥98% 5747-48-8 25mg $202 2026-04-30 Buy
Cayman Chemical 36687 Norquetiapine ≥98% 5747-48-8 50mg $358 2026-04-30 Buy
Cayman Chemical 36687 Norquetiapine ≥98% 5747-48-8 100mg $673 2026-04-30 Buy
Usbiological 292235 11-Piperazin-1-yl-dibenzo[b,f][1,4]thiazepine 5747-48-8 500mg $566 2026-06-03 Buy
Product number Packaging Price Buy
36687 10mg $85 Buy
36687 25mg $202 Buy
36687 50mg $358 Buy
36687 100mg $673 Buy
292235 500mg $566 Buy

11-(PIPERAZIN-1-YL)DIBENZO[B,F][1,4]THIAZEPINE Chemical Properties,Uses,Production

Chemical Properties

Pale-Yellow Solid

Uses

11-(Piperazin-1-yl)dibenzo[b,f][1,4]thiazepine is a metabolite of Quetiapine, a Benzothiazepine with mixed serotonin and dopamine receptor antagonistic properties used as an antipsychotic.

Definition

ChEBI: Norquetiapine is a dibenzothiazepine.

Synthesis

11-(1-PIPERAZINYL)-DIBENZO[B,F][1,4]THIAZEPIN HYDROCHLORIDE

753475-15-9

11-(PIPERAZIN-1-YL)DIBENZO[B,F][1,4]THIAZEPINE

5747-48-8

General procedure for the synthesis of 11-(1-piperazinyl)dibenzo[b,f][1,4]thiazepine from 11-(piperazin-1-yl)dibenzo[b,f][1,4]thiazepine hydrochloride: a toluene solution of 11-chloro-dibenzo[b,f][1,4]thiazepine (1500 mL, 0.686 mol) was mixed with 1500 mL of deionized water and 90 mL of HCl (32% w/w) were mixed. The reaction mixture was heated to 70 °C and stirred for 45 min. Stirring was stopped and allowed to stand for 30 minutes for phase separation. The lower aqueous phase was separated, which contained the HCl salt of 11-piperazin-1-yl dibenzo[b,f][1,4]thiazepine. Subsequently, the aqueous phase was treated with 1000 mL of toluene and 99 g aqueous NaOH (47% w/w). The mixture was heated to 70 °C and stirred for 45 min. Stirring was stopped and allowed to stand for 30 min for phase separation. The lower aqueous phase was discarded, the upper organic phase was retained and 300 mL of deionized water was added to it. The mixture was stirred for 15 minutes and then allowed to stand for 30 minutes. The aqueous phase was discarded and the organic phase was again extracted with 300 mL of deionized water. Approximately 750 mL of toluene was removed by distillation and the concentrate was cooled to 60°C. 200 mL of methyl tertiary butyl ether (MTBE) was added. The mixture was cooled to room temperature and inoculated with Type A crystalline seed. Subsequently, the mixture was cooled to 10 °C and kept under slow stirring for 3 hours. The solid product was separated by filtration through a #3 sintered funnel. The solid was washed with 120 mL of MTBE at room temperature and finally dried under vacuum at 40 °C to give 175 g (86.4% yield) of crystalline product.HPLC analysis showed a product purity of 99.9% w/w.

References

[1] Patent: WO2006/73360, 2006, A1. Location in patent: Page/Page column 10-11
[2] Patent: WO2006/73360, 2006, A1. Location in patent: Page/Page column 10
[3] Patent: WO2007/62338, 2007, A2. Location in patent: Page/Page column 13-14
[4] Patent: WO2007/62337, 2007, A2. Location in patent: Page/Page column 13-14
[5] Patent: WO2007/62337, 2007, A2. Location in patent: Page/Page column 14

Global( 92)Suppliers
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AFINE CHEMICALS LIMITED
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RR Scientific LLC
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View Lastest Price from 11-(PIPERAZIN-1-YL)DIBENZO[B,F][1,4]THIAZEPINE manufacturers

Image Update time Product Price Min. Order Purity Supply Ability Manufacturer
11-(PIPERAZIN-1-YL)DIBENZO[B,F][1,4]THIAZEPINE pictures 2019-12-23 11-(PIPERAZIN-1-YL)DIBENZO[B,F][1,4]THIAZEPINE
5747-48-8
$9.80 1g ≥99% 100kg Career Henan Chemical Co
11-(piperazin-1-yl)dibenzo[b,f][1,4]thiazepine 11-Piperazinodibenzo[b,f][1,4]thiazepine 11-(Piperazin-1-yl) 11-(1-Piperazinyl)-dibenzo[b,f][1,4]thiazepine 2-(Piperazin-1-yl)dithiazepin 7-chloro-2-(2-methylphenyl)-3,1-benzoxazin-4-one N-Des[2-(2-hydroxyethoxy)ethyl] Quetiapine N-Des[2-(2-hydroxyethoxy)ethyl] QuetiapineDiscontinued See: D288740 Dibenzo[b,f][1,4]thiazepine, 11-(1-piperazinyl)- (Z)-11-(piperidin-4-yl)dibenzo[b,f][1,4]thiazepine N-desalkyl QuetiapineQ: What is N-desalkyl Quetiapine Q: What is the CAS Number of N-desalkyl Quetiapine Q: What is the storage condition of N-desalkyl Quetiapine 6-piperazin-1-ylbenzo[b][1,4]benzothiazepine Quetiapine Impurity 28 Monomer (Quetiapine EP Impurity B) Norquetiapine (Standard) N-Desalkylquetiapine Norquetiapine 5747-48-8 Heterocycles Intermediates & Fine Chemicals Metabolites & Impurities Pharmaceuticals
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