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10,11-Dihydro-5-methyl-5H-dibenzo(a,d)cyclohepten-5,10-imine structure
Fine Chemical

10,11-Dihydro-5-methyl-5H-dibenzo(a,d)cyclohepten-5,10-imine

TL;DR: 10,11-Dihydro-5-methyl-5H-dibenzo(a,d)cyclohepten-5,10-imine (CAS 70449-94-4) is a chemical compound with molecular formula C16H15N and molecular weight 221.12045 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

1-methyl-16-azatetracyclo[7.6.1.02,7.010,15]hexadeca-2,4,6,10,12,14-hexaene

Also Known As: Neurogard, DIZOCILPINE, [3H]dizocilpine, (Rac)-Dizocilpine, Dizocilpine [INN]

CAS Number
70449-94-4
Molecular Formula
C16H15N
Molecular Weight
221.12045 g/mol
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Application Areas

Top 5 of 7 IPC patent classification(s) from the SureChEMBL global patent database.

Agrochemicals (3 patents) Catalysts (1 patents) Heterocyclic Building Blocks (57 patents) Organic Building Blocks (33 patents) Organometallic Reagents (2 patents)

Technical Specifications

Molecular FormulaC16H15N
Molecular Weight221.12045 g/mol
XLogP2.8
Topological Polar Surface Area (TPSA)12.0 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors1
Rotatable Bonds0
Exact Mass221.12045 Da
Heavy Atoms17
Complexity313.0
SMILESCC12C3=CC=CC=C3CC(N1)C4=CC=CC=C24
InChIKeyLBOJYSIDWZQNJS-UHFFFAOYSA-N

Product Description

Applications: 10,11-Dihydro-5-methyl-5H-dibenzo(a,d)cyclohepten-5,10-imine is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies 10,11-Dihydro-5-methyl-5H-dibenzo(a,d)cyclohepten-5,10-imine (CAS 70449-94-4) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.

A pharmaceutical intermediate supplied by CoreyChem, 10,11-Dihydro-5-methyl-5H-dibenzo(a,d)cyclohepten-5,10-imine (CAS 70449-94-4) has the molecular formula C16H15N and a molecular weight of 221.12 g/mol. It is also known as Neurogard and DIZOCILPINE.

Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.

Chemical Property Profile of 10,11-Dihydro-5-methyl-5H-dibenzo(a,d)cyclohepten-5,10-imine

XLogP
2.8
TPSA (Topological Polar Surface Area)
12.0
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
1
Rotatable Bonds
0
Heavy Atoms
17
Complexity
313.0
Exact Mass
221.12045
Monoisotopic Mass
221.12045
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 10,11-Dihydro-5-methyl-5H-dibenzo(a,d)cyclohepten-5,10-imine

The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 10,11-Dihydro-5-methyl-5H-dibenzo(a,d)cyclohepten-5,10-imine. With a topological polar surface area (TPSA) of 12.0 Ų, 10,11-Dihydro-5-methyl-5H-dibenzo(a,d)cyclohepten-5,10-imine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 10,11-Dihydro-5-methyl-5H-dibenzo(a,d)cyclohepten-5,10-imine has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 10,11-Dihydro-5-methyl-5H-dibenzo(a,d)cyclohepten-5,10-imine?

The CAS number of 10,11-Dihydro-5-methyl-5H-dibenzo(a,d)cyclohepten-5,10-imine is 70449-94-4.

What is the molecular formula of 10,11-Dihydro-5-methyl-5H-dibenzo(a,d)cyclohepten-5,10-imine?

The molecular formula of 10,11-Dihydro-5-methyl-5H-dibenzo(a,d)cyclohepten-5,10-imine is C16H15N.

What is the molecular weight of 10,11-Dihydro-5-methyl-5H-dibenzo(a,d)cyclohepten-5,10-imine?

The molecular weight of 10,11-Dihydro-5-methyl-5H-dibenzo(a,d)cyclohepten-5,10-imine is 221.12045 g/mol.

What are the applications of 10,11-Dihydro-5-methyl-5H-dibenzo(a,d)cyclohepten-5,10-imine?

10,11-Dihydro-5-methyl-5H-dibenzo(a,d)cyclohepten-5,10-imine is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. CoreyChem...

Where can I buy 10,11-Dihydro-5-methyl-5H-dibenzo(a,d)cyclohepten-5,10-imine?

You can request a quote for 10,11-Dihydro-5-methyl-5H-dibenzo(a,d)cyclohepten-5,10-imine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 10,11-Dihydro-5-methyl-5H-dibenzo(a,d)cyclohepten-5,10-imine?

Yes, CoreyChem provides custom synthesis services for 10,11-Dihydro-5-methyl-5H-dibenzo(a,d)cyclohepten-5,10-imine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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