Quetiapine structure, CAS 111974-69-7

Quetiapine

CAS Number111974-69-7

Synonymsquetiapina; 2-{2-4-(dibenzob,f1,4thiazepin-11-yl)piperazin-1-ylethoxy}ethanol; 11-(4-[2-(2-hydroxyethoxy)ethyl]-1-piperazinyl)-dibenzo[b,f][1,4]thiazepine; MFCD08064204; Seroquel; 2-(2-(4-dibenzo[b,f][1,4]thiazepine-11-yl-1-piperazinyl)ethoxy)ethanol; UNII-BGL0JSY5SI; 11-[4-[2-(2-hydroxyethoxy)ethyl]-1-piperazinyl]dibenzo[b,f][1,4]thiazepine; 2-[2-(4-benzo[b][1,4]benzothiazepin-6-ylpiperazin-1-yl)ethoxy]ethanol; 2-{[2-(4-dibenzo[b,f][1,4]thiazepin-11-ylpiperazin-1-yl)ethyl]oxy}ethanol; Co-Quetiapine; 2-{2-[4-(Dibenzo[b,f][1,4]thiazepin-11-yl)piperazin-1-yl]ethoxy}ethanol; quetiapinum; 2-{2-[4-(Dibenzo[b,f][1,4]thiazepin-11-yl)-1-piperazinyl]ethoxy}ethanol; Quetiapine [INN:BAN]; 2-(2-(4-Dibenzo(b,f)(1,4)thiazepine-11-yl-1-piperazinyl)ethoxy)ethanol

Molecular FormulaC21H25O2N3S1

Molecular Weight383.51

Purity98%

Density1.3±0.1 g/cm3

Boiling Point556.5±60.0 °C at 760 mmHg

Melting Point172 - 174ºC

Flash Point

AppearanceWhite to off-white crystalline powder

EINECS

MSDSChineseEnglish

Symbol

Signal Word

Cat. No.: 2A-9012225 Purity: 98%
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Quality Control of [ 111974-69-7 ] Purity: 98% SDS Specification MoL

Chemical & Physical Properties
CAS Number111974-69-7
Catalog No.2A-9012225
Chinese Name喹硫平
Synonymsquetiapina; 2-{2-4-(dibenzob,f1,4thiazepin-11-yl)piperazin-1-ylethoxy}ethanol; 11-(4-[2-(2-hydroxyethoxy)ethyl]-1-piperazinyl)-dibenzo[b,f][1,4]thiazepine; MFCD08064204; Seroquel; 2-(2-(4-dibenzo[b,f][1,4]thiazepine-11-yl-1-piperazinyl)ethoxy)ethanol; UNII-BGL0JSY5SI; 11-[4-[2-(2-hydroxyethoxy)ethyl]-1-piperazinyl]dibenzo[b,f][1,4]thiazepine; 2-[2-(4-benzo[b][1,4]benzothiazepin-6-ylpiperazin-1-yl)ethoxy]ethanol; 2-{[2-(4-dibenzo[b,f][1,4]thiazepin-11-ylpiperazin-1-yl)ethyl]oxy}ethanol; Co-Quetiapine; 2-{2-[4-(Dibenzo[b,f][1,4]thiazepin-11-yl)piperazin-1-yl]ethoxy}ethanol; quetiapinum; 2-{2-[4-(Dibenzo[b,f][1,4]thiazepin-11-yl)-1-piperazinyl]ethoxy}ethanol; Quetiapine [INN:BAN]; 2-(2-(4-Dibenzo(b,f)(1,4)thiazepine-11-yl-1-piperazinyl)ethoxy)ethanol
Molecular FormulaC21H25O2N3S1
Molecular Weight383.51
Purity98
Density1.3±0.1 g/cm3
Boiling Point556.5±60.0 °C at 760 mmHg
Melting Point172 - 174ºC
AppearanceWhite to off-white crystalline powder
Storage Condition-20℃
ApplicationQuetiapine (Ketipinor) is an atypical antipsychotic compound that can act on schizophrenia, mania and depression.
HTC2934999090
MDL NumberMFCD00866699
SMILESOCCOCCN1CCN(C2=Nc3ccccc3Sc3ccccc32)CC1
InChIInChI=1S/C21H25N3O2S/c25-14-16-26-15-13-23-9-11-24(12-10-23)21-17-5-1-3-7-19(17)27-20-8-4-2-6-18(20)22-21/h1-8,25H,9-16H2
InChI KeyURKOMYMAXPYINW-UHFFFAOYSA-N
MSDSmsds/12225_1_111974_69_7.pdf
Use ofQuetiapine(Ketipinor) is an atypical antipsychotic used in the treatment of schizophrenia, bipolar I mania, bipolar II depression, bipolar I depression.IC50 value: Target: 5-HT ReceptorQuetiapine is indicated for the treatment of schizophrenia as well as for the treatment of acute manic episodes associated with bipolar I disorder. The antipsychotic effect of quetiapine is thought by some to be mediated through antagonist activity at dopamine and serotonin receptors. Specifically the D1 and D2 dopamine, the alpha 1 adrenoreceptor and alpha 2 adrenoreceptor, and 5-HT1A and 5-HT2 serotonin receptor subtypes are antagonized. Quetiapine also has an antagonistic effect on the histamine H1 receptor. Properties Name quetiapine Synonym More Synonyms Quetiapine Biological Activity Description Quetiapine(Ketipinor) is an atypical antipsychotic used in the treatment of schizophrenia, bipolar I mania, bipolar II depression, bipolar I depression.IC50 value: Target: 5-HT ReceptorQuetiapine is indicated for the treatment of schizophrenia as well as for the treatment of acute manic episodes associated with bipolar I disorder. The antipsychotic effect of quetiapine is thought by some to be mediated through antagonist activity at dopamine and serotonin receptors. Specifically the D1 and D2 dopamine, the alpha 1 adrenoreceptor and alpha 2 adrenoreceptor, and 5-HT1A and 5-HT2 serotonin receptor subtypes are antagonized. Quetiapine also has an antagonistic effect on the histamine H1 receptor. Related Catalog Signaling Pathways >> GPCR/G Protein >> 5-HT Receptor Signaling Pathways >> Neuronal Signaling >> 5-HT Receptor Research Areas >> Neurological Disease References [1]. Sheehan DV, et al. Long-term functioning and sleep quality in patients with major depressive disorder treated with extended-release quetiapine fumarate. Int Clin Psychopharmacol. 2012 Sep;27(5):239-48. [2]. Endicott J, et al. Effects of once-daily extended release quetiapine fumarate on patient-reported outcomes in patients with generalized anxiety disorder. Neuropsychiatr Dis Treat. 2012;8:301-311. [5]. Katila H, et al. Randomized, Double-Blind Study of the Efficacy and Tolerability of Extended Release Quetiapine Fumarate (Quetiapine XR) Monotherapy in Elderly Patients With Major Depressive Disorder.Am J Geriatr Psychiatry. 2012 Jun 7. Chemical & Physical Properties Molecular Formula C21H25N3O2S Exact Mass 383.166748 PSA 73.60000 Index of Refraction 1.653 InChIKey URKOMYMAXPYINW-UHFFFAOYSA-N Storage condition -20℃ Safety Information HS Code 2934999090 Synthetic Route 11-(1-Piperazin... 753475-15-9 2-(2-Chloroetho... Quetiapine 111974-69-7 11-(1-Piperazin... 2-(2-Chloroetho... Quetiapine 111974-69-7 2-(2-(4-(Dibenz... 844639-07-2 Quetiapine 111974-69-7 Precursor & DownStream Precursor 10 CAS#:753475-15-9 11-(1-Piperazin... CAS#:628-89-7 2-(2-Chloroetho... CAS#:5747-48-8 11-(1-Piperazin... CAS#:844639-07-2 2-(2-(4-(Dibenz... DownStream 0
Tax Rebate13.0%
SupervisionNone. MFN tariff: 6.5%. Ordinary tariff: 20.0%
Transport InfoProduct name: Summary 2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%
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