2,3,4,5,6-pentakis-phenyl-3H-azepine
TL;DR: 2,3,4,5,6-pentakis-phenyl-3H-azepine (CAS 33070-61-0) is a chemical compound with molecular formula C36H27N and molecular weight 473.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3,4,5,6-pentakis-phenyl-3H-azepine
Also Known As: 2,3,4,5,6-pentakis-phenyl-3H-azepine, 2,3,4,5,6-Pentaphenyl-3H-azepine
| Molecular Formula | C36H27N |
|---|---|
| Molecular Weight | 473.21 g/mol |
| LogP | 7.9 |
| Topological Polar Surface Area | 12.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 473.21436 |
| Heavy Atoms | 37 |
| Complexity | 815.0 |
Chemical Identifiers
| CAS Number | 33070-61-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2C(=C(C(=CN=C2C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6 |
| InChIKey | BMHHJGYDAZHKQN-UHFFFAOYSA-N |
Product Overview
2,3,4,5,6-pentakis-phenyl-3H-azepine (CAS 33070-61-0), with molecular formula C36H27N and molecular weight 473.21 g/mol. IUPAC: 2,3,4,5,6-pentakis-phenyl-3H-azepine.
Chemical Property Profile of 2,3,4,5,6-pentakis-phenyl-3H-azepine
Property Insights of 2,3,4,5,6-pentakis-phenyl-3H-azepine
The XLogP value of 7.9 indicates that 2,3,4,5,6-pentakis-phenyl-3H-azepine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.4 Ų, 2,3,4,5,6-pentakis-phenyl-3H-azepine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3,4,5,6-pentakis-phenyl-3H-azepine has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,3,4,5,6-pentakis-phenyl-3H-azepine?
The CAS number of 2,3,4,5,6-pentakis-phenyl-3H-azepine is 33070-61-0.
What is the molecular formula of 2,3,4,5,6-pentakis-phenyl-3H-azepine?
The molecular formula of 2,3,4,5,6-pentakis-phenyl-3H-azepine is C36H27N.
What is the molecular weight of 2,3,4,5,6-pentakis-phenyl-3H-azepine?
The molecular weight of 2,3,4,5,6-pentakis-phenyl-3H-azepine is 473.21 g/mol.
Where can I buy 2,3,4,5,6-pentakis-phenyl-3H-azepine?
You can request a quote for 2,3,4,5,6-pentakis-phenyl-3H-azepine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3,4,5,6-pentakis-phenyl-3H-azepine?
Yes, KEHONG BIO provides custom synthesis services for 2,3,4,5,6-pentakis-phenyl-3H-azepine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.