BRN 4604730
TL;DR: BRN 4604730 (CAS 78932-98-6) is a chemical compound with molecular formula C26H28N4O4 and molecular weight 460.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4,5-dimethoxy-2-nitrophenyl)-N-[4-[4-(2-methylphenyl)piperazin-1-yl]phenyl]methanimine
Also Known As: N-((4,5-Dimethoxy-2-nitrophenyl)methylene)-4-(4-(2-methylphenyl)-1-piperazinyl)benzenamine, Benzenamine, N-((4,5-dimethoxy-2-nitrophenyl)methylene)-4-(4-(2-methylphenyl)-1-piperazinyl)-, 1-(4,5-dimethoxy-2-nitrophenyl)-N-[4-[4-(2-methylphenyl)piperazin-1-yl]phenyl]methanimine, BRN 4604730
| Molecular Formula | C26H28N4O4 |
|---|---|
| Molecular Weight | 460.21 g/mol |
| LogP | 5.1 |
| Topological Polar Surface Area | 83.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 460.21106 |
| Heavy Atoms | 34 |
| Complexity | 670.0 |
Chemical Identifiers
| CAS Number | 78932-98-6 |
|---|---|
| SMILES | CC1=CC=CC=C1N2CCN(CC2)C3=CC=C(C=C3)N=CC4=CC(=C(C=C4[N+](=O)[O-])OC)OC |
| InChIKey | JBMVKKJVGQQCTG-UHFFFAOYSA-N |
Product Overview
BRN 4604730 (CAS 78932-98-6), with molecular formula C26H28N4O4 and molecular weight 460.21 g/mol. IUPAC: 1-(4,5-dimethoxy-2-nitrophenyl)-N-[4-[4-(2-methylphenyl)piperazin-1-yl]phenyl]methanimine.
Chemical Property Profile of BRN 4604730
Property Insights of BRN 4604730
The XLogP value of 5.1 indicates that BRN 4604730 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.1 Ų falls within the moderate polarity range, balancing permeability and solubility for BRN 4604730. Following Lipinski's Rule of Five, BRN 4604730 has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BRN 4604730?
The CAS number of BRN 4604730 is 78932-98-6.
What is the molecular formula of BRN 4604730?
The molecular formula of BRN 4604730 is C26H28N4O4.
What is the molecular weight of BRN 4604730?
The molecular weight of BRN 4604730 is 460.21 g/mol.
Where can I buy BRN 4604730?
You can request a quote for BRN 4604730 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BRN 4604730?
Yes, KEHONG BIO provides custom synthesis services for BRN 4604730 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.