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Azepindole structure
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Azepindole

TL;DR: Azepindole (CAS 26304-61-0) is a chemical compound with molecular formula C12H14N2 and molecular weight 186.11569 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2,3,4,5-tetrahydro-1H-[1,4]diazepino[1,2-a]indole

Also Known As: Azepindol, Azepindole [USAN:INN], AZEPINDOLE [INN], Azepindole (USAN/INN), AZEPINDOLE [USAN]

CAS Number
26304-61-0
Molecular Formula
C12H14N2
Molecular Weight
186.11569 g/mol
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Application Areas

Top 5 of 4 IPC patent classification(s) from the SureChEMBL global patent database.

Agrochemicals (1 patents) Heterocyclic Building Blocks (5 patents) Pharmaceutical Intermediates (136 patents) Photographic Chemicals (4 patents)

Technical Specifications

Molecular FormulaC12H14N2
Molecular Weight186.11569 g/mol
XLogP1.5
Topological Polar Surface Area (TPSA)17.0 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors1
Rotatable Bonds0
Exact Mass186.11569 Da
Heavy Atoms14
Complexity204.0
SMILESC1CNCC2=CC3=CC=CC=C3N2C1
InChIKeyFEJCIXJKPISCJV-UHFFFAOYSA-N

Chemical Property Profile of Azepindole

XLogP
1.5
TPSA (Topological Polar Surface Area)
17.0
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
1
Rotatable Bonds
0
Heavy Atoms
14
Complexity
204.0
Exact Mass
186.11569
Monoisotopic Mass
186.11569
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 Azepindole

The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Azepindole. With a topological polar surface area (TPSA) of 17.0 Ų, Azepindole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Azepindole 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 Azepindole?

The CAS number of Azepindole is 26304-61-0.

What is the molecular formula of Azepindole?

The molecular formula of Azepindole is C12H14N2.

What is the molecular weight of Azepindole?

The molecular weight of Azepindole is 186.11569 g/mol.

Where can I buy Azepindole?

You can request a quote for Azepindole directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Azepindole?

Yes, CoreyChem provides custom synthesis services for Azepindole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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