N,N'-Bis(hexahydro-1-methyl-2H-azepin-2-ylidene)-1,4-benzenediamine
TL;DR: N,N'-Bis(hexahydro-1-methyl-2H-azepin-2-ylidene)-1,4-benzenediamine (CAS 84859-24-5) is a chemical compound with molecular formula C20H30N4 and molecular weight 326.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-N-[4-[(1-methylazepan-2-ylidene)amino]phenyl]azepan-2-imine
Also Known As: N,N'-Bis(hexahydro-1-methyl-2H-azepin-2-ylidene)-1,4-benzenediamine, 1,4-Benzenediamine, N,N'-bis(hexahydro-1-methyl-2H-azepin-2-ylidene)-, 1-methyl-N-[4-[(1-methylazepan-2-ylidene)amino]phenyl]azepan-2-imine, BRN 4527222
| Molecular Formula | C20H30N4 |
|---|---|
| Molecular Weight | 326.25 g/mol |
| LogP | 4.7582 |
| Topological Polar Surface Area | 31.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 326.24704 |
| Heavy Atoms | 24 |
| Complexity | 535.1613 |
Chemical Identifiers
| CAS Number | 84859-24-5 |
|---|---|
| SMILES | CN1CCCCCC1=NC2=CC=C(C=C2)N=C3CCCCCN3C |
Product Overview
N,N'-Bis(hexahydro-1-methyl-2H-azepin-2-ylidene)-1,4-benzenediamine (CAS 84859-24-5), with molecular formula C20H30N4 and molecular weight 326.25 g/mol. IUPAC: 1-methyl-N-[4-[(1-methylazepan-2-ylidene)amino]phenyl]azepan-2-imine.
Chemical Property Profile of N,N'-Bis(hexahydro-1-methyl-2H-azepin-2-ylidene)-1,4-benzenediamine
Property Insights of N,N'-Bis(hexahydro-1-methyl-2H-azepin-2-ylidene)-1,4-benzenediamine
The XLogP value of 4.7582 indicates that N,N'-Bis(hexahydro-1-methyl-2H-azepin-2-ylidene)-1,4-benzenediamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 31.2 Ų, N,N'-Bis(hexahydro-1-methyl-2H-azepin-2-ylidene)-1,4-benzenediamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N'-Bis(hexahydro-1-methyl-2H-azepin-2-ylidene)-1,4-benzenediamine has 0 hydrogen bond donor(s) and 2 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 N,N'-Bis(hexahydro-1-methyl-2H-azepin-2-ylidene)-1,4-benzenediamine?
The CAS number of N,N'-Bis(hexahydro-1-methyl-2H-azepin-2-ylidene)-1,4-benzenediamine is 84859-24-5.
What is the molecular formula of N,N'-Bis(hexahydro-1-methyl-2H-azepin-2-ylidene)-1,4-benzenediamine?
The molecular formula of N,N'-Bis(hexahydro-1-methyl-2H-azepin-2-ylidene)-1,4-benzenediamine is C20H30N4.
What is the molecular weight of N,N'-Bis(hexahydro-1-methyl-2H-azepin-2-ylidene)-1,4-benzenediamine?
The molecular weight of N,N'-Bis(hexahydro-1-methyl-2H-azepin-2-ylidene)-1,4-benzenediamine is 326.25 g/mol.
Where can I buy N,N'-Bis(hexahydro-1-methyl-2H-azepin-2-ylidene)-1,4-benzenediamine?
You can request a quote for N,N'-Bis(hexahydro-1-methyl-2H-azepin-2-ylidene)-1,4-benzenediamine 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(hexahydro-1-methyl-2H-azepin-2-ylidene)-1,4-benzenediamine?
Yes, KEHONG BIO provides custom synthesis services for N,N'-Bis(hexahydro-1-methyl-2H-azepin-2-ylidene)-1,4-benzenediamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.