4(2)-Bromo-1,4(1,4)-dibenzenacyclohexaphan-1(2)-amine
TL;DR: 4(2)-Bromo-1,4(1,4)-dibenzenacyclohexaphan-1(2)-amine (CAS 202345-41-3) is a chemical compound with molecular formula C16H16BrN and molecular weight 301.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
12-bromotricyclo[8.2.2.24,7]hexadeca-1(12),4,6,10,13,15-hexaen-5-amine
Also Known As: J2.607.427D, J2.890.846F, J2.890.852K, 4(2)-Bromo-1,4(1,4)-dibenzenacyclohexaphan-1(2)-amine, (aR)-2,5-(2-Bromo-1,4-phenylenebisethylene)aniline
| Molecular Formula | C16H16BrN |
|---|---|
| Molecular Weight | 301.05 g/mol |
| LogP | 3.9151 |
| Topological Polar Surface Area | 26.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 301.0466 |
| Heavy Atoms | 18 |
| Complexity | 536.146 |
Chemical Identifiers
| CAS Number | 202345-41-3 |
|---|---|
| SMILES | C1CC2=CC(=C(CCC3=C(C=C1C=C3)N)C=C2)Br |
Product Overview
4(2)-Bromo-1,4(1,4)-dibenzenacyclohexaphan-1(2)-amine (CAS 202345-41-3), with molecular formula C16H16BrN and molecular weight 301.05 g/mol. IUPAC: 12-bromotricyclo[8.2.2.24,7]hexadeca-1(12),4,6,10,13,15-hexaen-5-amine.
Chemical Property Profile of 4(2)-Bromo-1,4(1,4)-dibenzenacyclohexaphan-1(2)-amine
Property Insights of 4(2)-Bromo-1,4(1,4)-dibenzenacyclohexaphan-1(2)-amine
The XLogP value of 3.9151 indicates that 4(2)-Bromo-1,4(1,4)-dibenzenacyclohexaphan-1(2)-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.02 Ų, 4(2)-Bromo-1,4(1,4)-dibenzenacyclohexaphan-1(2)-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4(2)-Bromo-1,4(1,4)-dibenzenacyclohexaphan-1(2)-amine 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
Frequently Asked Questions
What is the CAS number of 4(2)-Bromo-1,4(1,4)-dibenzenacyclohexaphan-1(2)-amine?
The CAS number of 4(2)-Bromo-1,4(1,4)-dibenzenacyclohexaphan-1(2)-amine is 202345-41-3.
What is the molecular formula of 4(2)-Bromo-1,4(1,4)-dibenzenacyclohexaphan-1(2)-amine?
The molecular formula of 4(2)-Bromo-1,4(1,4)-dibenzenacyclohexaphan-1(2)-amine is C16H16BrN.
What is the molecular weight of 4(2)-Bromo-1,4(1,4)-dibenzenacyclohexaphan-1(2)-amine?
The molecular weight of 4(2)-Bromo-1,4(1,4)-dibenzenacyclohexaphan-1(2)-amine is 301.05 g/mol.
Where can I buy 4(2)-Bromo-1,4(1,4)-dibenzenacyclohexaphan-1(2)-amine?
You can request a quote for 4(2)-Bromo-1,4(1,4)-dibenzenacyclohexaphan-1(2)-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4(2)-Bromo-1,4(1,4)-dibenzenacyclohexaphan-1(2)-amine?
Yes, KEHONG BIO provides custom synthesis services for 4(2)-Bromo-1,4(1,4)-dibenzenacyclohexaphan-1(2)-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.