2,6-Bis(4-bromophenyl)-4-methyl-5-phenylhept-2-enedinitrile
TL;DR: 2,6-Bis(4-bromophenyl)-4-methyl-5-phenylhept-2-enedinitrile (CAS 128349-98-4) is a chemical compound with molecular formula C26H20Br2N2 and molecular weight 518.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,6-bis(4-bromophenyl)-4-methyl-5-phenylhept-2-enedinitrile
Also Known As: 2,6-Bis(4-bromophenyl)-4-methyl-5-phenyl-2-heptenedinitrile
| Molecular Formula | C26H20Br2N2 |
|---|---|
| Molecular Weight | 518.00 g/mol |
| LogP | 7.2 |
| Topological Polar Surface Area | 47.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 517.9993 |
| Heavy Atoms | 30 |
| Complexity | 662.0 |
Chemical Identifiers
| CAS Number | 128349-98-4 |
|---|---|
| SMILES | CC(C=C(C#N)C1=CC=C(C=C1)Br)C(C2=CC=CC=C2)C(C#N)C3=CC=C(C=C3)Br |
| InChIKey | ZLEHCLNLLVMAEK-UHFFFAOYSA-N |
Product Overview
2,6-Bis(4-bromophenyl)-4-methyl-5-phenylhept-2-enedinitrile (CAS 128349-98-4), with molecular formula C26H20Br2N2 and molecular weight 518.00 g/mol. IUPAC: 2,6-bis(4-bromophenyl)-4-methyl-5-phenylhept-2-enedinitrile.
Chemical Property Profile of 2,6-Bis(4-bromophenyl)-4-methyl-5-phenylhept-2-enedinitrile
Property Insights of 2,6-Bis(4-bromophenyl)-4-methyl-5-phenylhept-2-enedinitrile
The XLogP value of 7.2 indicates that 2,6-Bis(4-bromophenyl)-4-methyl-5-phenylhept-2-enedinitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.6 Ų, 2,6-Bis(4-bromophenyl)-4-methyl-5-phenylhept-2-enedinitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,6-Bis(4-bromophenyl)-4-methyl-5-phenylhept-2-enedinitrile has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,6-Bis(4-bromophenyl)-4-methyl-5-phenylhept-2-enedinitrile?
The CAS number of 2,6-Bis(4-bromophenyl)-4-methyl-5-phenylhept-2-enedinitrile is 128349-98-4.
What is the molecular formula of 2,6-Bis(4-bromophenyl)-4-methyl-5-phenylhept-2-enedinitrile?
The molecular formula of 2,6-Bis(4-bromophenyl)-4-methyl-5-phenylhept-2-enedinitrile is C26H20Br2N2.
What is the molecular weight of 2,6-Bis(4-bromophenyl)-4-methyl-5-phenylhept-2-enedinitrile?
The molecular weight of 2,6-Bis(4-bromophenyl)-4-methyl-5-phenylhept-2-enedinitrile is 518.00 g/mol.
Where can I buy 2,6-Bis(4-bromophenyl)-4-methyl-5-phenylhept-2-enedinitrile?
You can request a quote for 2,6-Bis(4-bromophenyl)-4-methyl-5-phenylhept-2-enedinitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,6-Bis(4-bromophenyl)-4-methyl-5-phenylhept-2-enedinitrile?
Yes, KEHONG BIO provides custom synthesis services for 2,6-Bis(4-bromophenyl)-4-methyl-5-phenylhept-2-enedinitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.