N,N'-Bis(4-heptyloxybenzylidene)-1,4-phenylenediamine
TL;DR: N,N'-Bis(4-heptyloxybenzylidene)-1,4-phenylenediamine (CAS 97139-97-4) is a chemical compound with molecular formula C34H44N2O2 and molecular weight 512.34 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-heptoxyphenyl)-N-[4-[(4-heptoxyphenyl)methylideneamino]phenyl]methanimine
Also Known As: Bis(p-heptyloxybenzylidene) p-Phenylenediamine, BIS P-PHENYLENEDIAMINE, Bis(p-heptyloxybenzylidene)-p-phenylenediamine, 4.4'-Dimethylamino-4''fluorotriphenylmethan, Bis(p-heptyloxybenzylidene)p-phenylenediamine
| Molecular Formula | C34H44N2O2 |
|---|---|
| Molecular Weight | 512.34 g/mol |
| LogP | 10.2 |
| Topological Polar Surface Area | 43.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 18 |
| Exact Mass | 512.3403 |
| Heavy Atoms | 38 |
| Complexity | 558.0 |
Chemical Identifiers
| CAS Number | 97139-97-4 |
|---|---|
| SMILES | CCCCCCCOC1=CC=C(C=C1)C=NC2=CC=C(C=C2)N=CC3=CC=C(C=C3)OCCCCCCC |
| InChIKey | FSYMJESEMBZVIC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N,N'-Bis(4-heptyloxybenzylidene)-1,4-phenylenediamine (CAS 97139-97-4), with molecular formula C34H44N2O2 and molecular weight 512.34 g/mol. IUPAC: 1-(4-heptoxyphenyl)-N-[4-[(4-heptoxyphenyl)methylideneamino]phenyl]methanimine.
Chemical Property Profile of N,N'-Bis(4-heptyloxybenzylidene)-1,4-phenylenediamine
Property Insights of N,N'-Bis(4-heptyloxybenzylidene)-1,4-phenylenediamine
The XLogP value of 10.2 indicates that N,N'-Bis(4-heptyloxybenzylidene)-1,4-phenylenediamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.2 Ų, N,N'-Bis(4-heptyloxybenzylidene)-1,4-phenylenediamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N'-Bis(4-heptyloxybenzylidene)-1,4-phenylenediamine has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N,N'-Bis(4-heptyloxybenzylidene)-1,4-phenylenediamine?
The CAS number of N,N'-Bis(4-heptyloxybenzylidene)-1,4-phenylenediamine is 97139-97-4.
What is the molecular formula of N,N'-Bis(4-heptyloxybenzylidene)-1,4-phenylenediamine?
The molecular formula of N,N'-Bis(4-heptyloxybenzylidene)-1,4-phenylenediamine is C34H44N2O2.
What is the molecular weight of N,N'-Bis(4-heptyloxybenzylidene)-1,4-phenylenediamine?
The molecular weight of N,N'-Bis(4-heptyloxybenzylidene)-1,4-phenylenediamine is 512.34 g/mol.
Where can I buy N,N'-Bis(4-heptyloxybenzylidene)-1,4-phenylenediamine?
You can request a quote for N,N'-Bis(4-heptyloxybenzylidene)-1,4-phenylenediamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N'-Bis(4-heptyloxybenzylidene)-1,4-phenylenediamine?
Yes, KEHONG BIO provides custom synthesis services for N,N'-Bis(4-heptyloxybenzylidene)-1,4-phenylenediamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.