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6,11-Dihydro-11-(1-methyl-4-piperidylidene)-5H-benzo[5,6]cyclohepta[1,2-b]pyridine structure, CAS 3964-81-6

6,11-Dihydro-11-(1-methyl-4-piperidylidene)-5H-benzo[5,6]cyclohepta[1,2-b]pyridine

CAS Number3964-81-6

Synonyms11-(1-methyl-piperidin-4-ylidene)-6,11-dihydro-5H-benzo[5,6]cyclohepta[1,2-b]pyridine; Azatadinum [INN-Latin]; Azatadina [INN-Spanish]; 11-(1-methylpiperidin-4-ylidene)-5,6-dihydrobenzo[1,2]cyclohepta[3,4-b]pyridine; Azatadina; Optimine; Azatadinum; Azatidine; Azatadine [INN:BAN]; 6,11-dihydro-11-(1-methyl-4-piperidinylidene)-5H-benzo[5,6]cyclohepta[1,2-b]pyridine; 6,11--dihydro-11-(N-methyl-4-piperidylidene)-5H-benzo-[5,6]-cyclohepta-[1,2-b]-pyridine; Azatadine maleate; Zadine; AZATADINE

Molecular FormulaC28H30O8N2

Molecular Weight522.55

Purity98.00%

Density1.127 g/cm3

Boiling Point450.1ºC at 760 mmHg

Melting Point124-126ºC

Flash Point

AppearanceWhite or off-white crystalline powder

EINECS

MSDSChineseEnglish

Symbol

Signal Word

Cat. No.: 2A-9030339 Purity: 98.00%
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Quality Control of [ 3964-81-6 ] Purity: 98.00% SDS Specification MoL

Chemical & Physical Properties
CAS Number3964-81-6
Catalog No.2A-9030339
Chinese Name6,11-二氢-11-(1-甲基-4-哌啶亚基)-5H-苯并[5,6]环庚烷并[1,2-b]吡啶
Synonyms11-(1-methyl-piperidin-4-ylidene)-6,11-dihydro-5H-benzo[5,6]cyclohepta[1,2-b]pyridine; Azatadinum [INN-Latin]; Azatadina [INN-Spanish]; 11-(1-methylpiperidin-4-ylidene)-5,6-dihydrobenzo[1,2]cyclohepta[3,4-b]pyridine; Azatadina; Optimine; Azatadinum; Azatidine; Azatadine [INN:BAN]; 6,11-dihydro-11-(1-methyl-4-piperidinylidene)-5H-benzo[5,6]cyclohepta[1,2-b]pyridine; 6,11--dihydro-11-(N-methyl-4-piperidylidene)-5H-benzo-[5,6]-cyclohepta-[1,2-b]-pyridine; Azatadine maleate; Zadine; AZATADINE
Molecular FormulaC28H30O8N2
Molecular Weight522.55
Purity98.00
Density1.127 g/cm3
Boiling Point450.1ºC at 760 mmHg
Melting Point124-126ºC
AppearanceWhite or off-white crystalline powder
Storage Condition2-8℃
ApplicationAzatadine is an inhibitor of histamine receptors and choline receptors, with IC50s of 6.5 nM and 10 nM respectively.
HTC2933990090
MDL NumberMFCD00242593
SMILESCN1CCC(=C2c3ccccc3CCc3cccnc32)CC1
InChIInChI=1S/C20H22N2/c1-22-13-10-16(11-14-22)19-18-7-3-2-5-15(18)8-9-17-6-4-12-21-20(17)19/h2-7,12H,8-11,13-14H2,1H3
InChI KeySEBMTIQKRHYNIT-UHFFFAOYSA-N
MSDSmsds/30339_1_3964_81_6.pdf
Use ofProperties Name azatadine Synonym More Synonyms Azatadine Biological Activity Related Catalog Signaling Pathways >> GPCR/G Protein >> Histamine Receptor Signaling Pathways >> Immunology/Inflammation >> Histamine Receptor Research Areas >> Inflammation/Immunology References [1]. Wilson JD, et al. Azatadine maleate (Zadine): evaluation in the management of allergic rhinitis. N Z Med J. 1981 Aug 12;94(689):79-81. [2]. Tozzi S, et al. The pharmacology of azatadine, a potential antiallergy drug. Agents Actions. 1974 Oct;4(4):264-70. Chemical & Physical Properties Molecular Formula C20H22N2 PSA 16.13000 LogP 3.64560 InChIKey SEBMTIQKRHYNIT-UHFFFAOYSA-N Storage condition 2-8℃ Safety Information HS Code 2933990090 Synthetic Route 5,6-dihydro-11H... CAS#:3964-73-6 CAS#:3964-81-6 Literature: Piwinski, John J.; Wong, Jesse K.; Green, Michael J.; Ganguly, Ashit K.; Billah, M. Motasim; et al. Journal of Medicinal Chemistry, 1991 , vol. 34, # 1 p. 457 - 461 N-tert-butyl-3-... CAS#:32998-95-1 CAS#:3964-81-6 Literature: Piwinski, John J.; Wong, Jesse K.; Green, Michael J.; Ganguly, Ashit K.; Billah, M. Motasim; et al. Journal of Medicinal Chemistry, 1991 , vol. 34, # 1 p. 457 - 461 Benzyl chloride CAS#:100-44-7 CAS#:3964-81-6 Literature: Piwinski, John J.; Wong, Jesse K.; Green, Michael J.; Ganguly, Ashit K.; Billah, M. Motasim; et al. Journal of Medicinal Chemistry, 1991 , vol. 34, # 1 p. 457 - 461 Precursor & DownStream Precursor 6 CAS#:3964-73-6 5,6-dihydro-11H... CAS#:32998-95-1 N-tert-butyl-3-... CAS#:100-44-7 Benzyl chloride CAS#:14578-23-5 3-phenethyl-pyr... DownStream 0
Tax Rebate13.0%
SupervisionNone. MFN tariff: 6.5%. Ordinary tariff: 20.0%
Transport InfoProduct name: Summary 2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%
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