Dibenzo[b,f][1,4]thiazepine, 11-(1-piperazinyl)-, hydrochloride (1:2)
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![Dibenzo[b,f][1,4]thiazepine, 11-(1-piperazinyl)-, hydrochloride (1:2) structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/0fdd75655e6e46bca4f824715a7a3e17.png "Dibenzo[b,f][1,4]thiazepine, 11-(1-piperazinyl)-, hydrochloride (1:2)")
Dibenzo[b,f][1,4]thiazepine, 11-(1-piperazinyl)-, hydrochloride (1:2)
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CAS No:
111974-74-4
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Formula:
C17H17N3S.2ClH
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Chemical Name:
Dibenzo[b,f][1,4]thiazepine, 11-(1-piperazinyl)-, hydrochloride (1:2)
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Synonyms:
Dibenzo[b,f][1,4]thiazepine,11-(1-piperazinyl)-,hydrochloride (1:2);Dibenzo[b,f][1,4]thiazepine,11-(1-piperazinyl)-,dihydrochloride;11-Piperazinodibenzo[b,f][1,4]thiazepine dihydrochloride;11-(1-Piperazinyl)-dibenzo[b,f][1,4]thiazepine dihydrochloride;11-Piperazin-1-yl-dibenzo[b,f][1,4]thiazepine dihydrochloride
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CAS No:
Dibenzo[b,f][1,4]thiazepine, 11-(1-piperazinyl)-, hydrochloride (1:2) Basic Attributes
368.32386
367.067688
1312995-182-4
7VJ4TC63IL
DTXSID60600505
2934999090
Safety Information
NONH for all modes of transport
P261, P264, P270, P271, P273, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P322, P330, P332+P313, P337+P313, P363, P501
H302
|Warning|H302 (83.33%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P273, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P322, P330, P332+P313, P337+P313, P363, and P501|Aggregated GHS information provided by 8 companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Dibenzo[b,f][1,4]thiazepine, 11-(1-piperazinyl)-, hydrochloride (1:2) Use and Manufacturing
A metabolite of Quetiapine, a Benzothiazepine with mixed serotonin and dopamine receptor antagonistic properties used as an antipsychotic
Computed Properties
Molecular Weight:368.3
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:367.0676742
Monoisotopic Mass:367.0676742
Topological Polar Surface Area:52.9
Heavy Atom Count:23
Complexity:392
Covalently-Bonded Unit Count:3
Compound Is Canonicalized:Yes
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Dibenzo[b,f][1,4]thiazepine, 11-(1-piperazinyl)-, hydrochloride (1:2)
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