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12-(adamantan-1-yl)-1,4-diazatetracyclo[7.6.1.0^{5,16}.0^{10,15}]hexadeca-9(16),10(15),11,13-tetraene hydrochloride structure
Fine Chemical

12-(adamantan-1-yl)-1,4-diazatetracyclo[7.6.1.0^{5,16}.0^{10,15}]hexadeca-9(16),10(15),11,13-tetraene hydrochloride

TL;DR: 12-(adamantan-1-yl)-1,4-diazatetracyclo[7.6.1.0^{5,16}.0^{10,15}]hexadeca-9(16),10(15),11,13-tetraene hydrochloride (CAS 141681-99-4) is a chemical compound with molecular formula C24H31ClN2 and molecular weight 382.2176 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

12-(1-adamantyl)-1,4-diazatetracyclo[7.6.1.05,16.010,15]hexadeca-9(16),10(15),11,13-tetraene;hydrochloride

Also Known As: 12-(adamantan-1-yl)-1,4-diazatetracyclo[7.6.1.0^{5,16}.0^{10,15}]hexadeca-9(16),10(15),11,13-tetraene hydrochloride, 8-((3r,5r,7r)-adamantan-1-yl)-2,3,3a,4,5,6-hexahydro-1H-pyrazino[3,2,1-jk]carbazole hydrochloride

CAS Number
141681-99-4
Molecular Formula
C24H31ClN2
Molecular Weight
382.2176 g/mol
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Technical Specifications

Molecular FormulaC24H31ClN2
Molecular Weight382.2176 g/mol
XLogP5.5115
Topological Polar Surface Area (TPSA)17.0 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors1
Rotatable Bonds1
Exact Mass382.2176 Da
Heavy Atoms27
Complexity543.0
SMILESC1CC2C3=C(C1)C4=C(N3CCN2)C=CC(=C4)C56CC7CC(C5)CC(C7)C6.Cl
InChIKeyZPMVHWNPNMNBAP-UHFFFAOYSA-N

Chemical Property Profile of 12-(adamantan-1-yl)-1,4-diazatetracyclo[7.6.1.0^{5,16}.0^{10,15}]hexadeca-9(16),10(15),11,13-tetraene hydrochloride

XLogP
5.5115
TPSA (Topological Polar Surface Area)
17.0
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
1
Rotatable Bonds
1
Heavy Atoms
27
Complexity
543.0
Exact Mass
382.2176
Monoisotopic Mass
382.2176
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of 12-(adamantan-1-yl)-1,4-diazatetracyclo[7.6.1.0^{5,16}.0^{10,15}]hexadeca-9(16),10(15),11,13-tetraene hydrochloride

The XLogP value of 5.5115 indicates that 12-(adamantan-1-yl)-1,4-diazatetracyclo[7.6.1.0^{5,16}.0^{10,15}]hexadeca-9(16),10(15),11,13-tetraene hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.0 Ų, 12-(adamantan-1-yl)-1,4-diazatetracyclo[7.6.1.0^{5,16}.0^{10,15}]hexadeca-9(16),10(15),11,13-tetraene hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 12-(adamantan-1-yl)-1,4-diazatetracyclo[7.6.1.0^{5,16}.0^{10,15}]hexadeca-9(16),10(15),11,13-tetraene hydrochloride has 2 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of 12-(adamantan-1-yl)-1,4-diazatetracyclo[7.6.1.0^{5,16}.0^{10,15}]hexadeca-9(16),10(15),11,13-tetraene hydrochloride?

The CAS number of 12-(adamantan-1-yl)-1,4-diazatetracyclo[7.6.1.0^{5,16}.0^{10,15}]hexadeca-9(16),10(15),11,13-tetraene hydrochloride is 141681-99-4.

What is the molecular formula of 12-(adamantan-1-yl)-1,4-diazatetracyclo[7.6.1.0^{5,16}.0^{10,15}]hexadeca-9(16),10(15),11,13-tetraene hydrochloride?

The molecular formula of 12-(adamantan-1-yl)-1,4-diazatetracyclo[7.6.1.0^{5,16}.0^{10,15}]hexadeca-9(16),10(15),11,13-tetraene hydrochloride is C24H31ClN2.

What is the molecular weight of 12-(adamantan-1-yl)-1,4-diazatetracyclo[7.6.1.0^{5,16}.0^{10,15}]hexadeca-9(16),10(15),11,13-tetraene hydrochloride?

The molecular weight of 12-(adamantan-1-yl)-1,4-diazatetracyclo[7.6.1.0^{5,16}.0^{10,15}]hexadeca-9(16),10(15),11,13-tetraene hydrochloride is 382.2176 g/mol.

Where can I buy 12-(adamantan-1-yl)-1,4-diazatetracyclo[7.6.1.0^{5,16}.0^{10,15}]hexadeca-9(16),10(15),11,13-tetraene hydrochloride?

You can request a quote for 12-(adamantan-1-yl)-1,4-diazatetracyclo[7.6.1.0^{5,16}.0^{10,15}]hexadeca-9(16),10(15),11,13-tetraene hydrochloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 12-(adamantan-1-yl)-1,4-diazatetracyclo[7.6.1.0^{5,16}.0^{10,15}]hexadeca-9(16),10(15),11,13-tetraene hydrochloride?

Yes, CoreyChem provides custom synthesis services for 12-(adamantan-1-yl)-1,4-diazatetracyclo[7.6.1.0^{5,16}.0^{10,15}]hexadeca-9(16),10(15),11,13-tetraene hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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