10-(1-Azabicyclo[2.2.2]oct-3-ylmethyl)-10H-phenothiazine

Basic Information

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CAS Number

29216-28-2

Molecular Formula

C20H22N2S

Molecular Weight

322.48 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Melting Point

146.0 to 150.0 deg-C

Boiling Point

469.4 °C at 760 mmHg

Flash Point

237.7 °C

Refractive Index

1.5800 (estimate)

SMILES

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C1CN2CCC1C(C2)CN3C4=CC=CC=C4SC5=CC=CC=C53

InChI

InChI=1S/C20H22N2S/c1-3-7-19-17(5-1)22(18-6-2-4-8-20(18)23-19)14-16-13-21-11-9-15(16)10-12-21/h1-8,15-16H,9-14H2

InChIKey

HOKDBMAJZXIPGC-UHFFFAOYSA-N

LogP

4.631100000000004

Topological Polar Surface Area

6.48 Å²

Hydrogen Bond Donor/Acceptor

0 / 2

Complexity

398

Safety Information

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GHS Hazard Pictograms

H301

Hazard Statement

H301 Toxic if swallowed
Acute toxicity, oral

Hazard Class

Class 6.1 Class 6.1

Sensitiveness

Sensitive to light

Synonyms & References

English

10-{1-azabicyclo[2.2.2]octan-3-ylmethyl}-10H-phenothiazine
10H-Phenothiazine, 10-(1-azabicyclo(2.2.2)oct-3-ylmethyl)-
CS-6222
(R)-10-(1-Azabicyclo[2.2.2]oct-3-ylmethyl)-10H-phenothiazine
SMR000528898
J-008412
Mequitazinum
MEQUITAZINE [WHO-DD]
MFCD00869383
Butix
L000704
Zesulan
AKOS000424971
AC-2365
DB01071
AB00691111-09
MLS000757058
NCGC00183046-01
BDBM430669
CHEBI:31821
MEQUITAZINE [MI]
CAS-29216-28-2
AKOS022061643
Mequitazine [INN:BAN:DCF:JAN]
M2807
10-(1-azabicyclo[2.2.2]octan-3-ylmethyl)phenothiazine
MEQUITAZINE [MART.]
BRN 1150945
NSC 303612
Mequitazine (JP17/INN)
NCI60_002566

MDL Number

MFCD00869383

Customs Code

2934300000

FAQ

What is 10-(1-Azabicyclo[2.2.2]oct-3-ylmethyl)-10H-phenothiazine (CAS: 29216-28-2)?

10-(1-Azabicyclo[2.2.2]oct-3-ylmethyl)-10H-phenothiazine is a complex organic compound with the CAS number 29216-28-2. It is a derivative of phenothiazine with azabicyclo substitution, displaying unique electronic and structural properties.

What are the main uses of 10-(1-Azabicyclo[2.2.2]oct-3-ylmethyl)-10H-phenothiazine (CAS: 29216-28-2)?

10-(1-Azabicyclo[2.2.2]oct-3-ylmethyl)-10H-phenothiazine is primarily used as an intermediate in the synthesis of pharmaceuticals, particularly for developing antipsychotic drugs. It is also used in research for studying molecular interactions and drug design.

Is 10-(1-Azabicyclo[2.2.2]oct-3-ylmethyl)-10H-phenothiazine (CAS: 29216-28-2) safe?

Safety measures are necessary when handling 10-(1-Azabicyclo[2.2.2]oct-3-ylmethyl)-10H-phenothiazine. It is not inherently toxic but can cause skin and eye irritation. Protective measures include wearing gloves, goggles, and a lab coat, and ensuring proper ventilation. It is advisable to consult the Material Safety Data Sheet (MSDS) for specific safety guidelines.

How should 10-(1-Azabicyclo[2.2.2]oct-3-ylmethyl)-10H-phenothiazine (CAS: 29216-28-2) be stored?

10-(1-Azabicyclo[2.2.2]oct-3-ylmethyl)-10H-phenothiazine should be stored in a cool, dry place, away from direct sunlight and sources of ignition. It should be kept in a tightly sealed container to prevent degradation. Optimal storage conditions are temperatures below 25°C and a relative humidity of less than 50%.