BRN 4216093
TL;DR: BRN 4216093 (CAS 127718-41-6) is a chemical compound with molecular formula C25H26ClN5O2 and molecular weight 463.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-chlorophenyl)imino-3,4-dimethoxy-N'-(4-phenylpiperazin-1-yl)benzenecarboximidamide
Also Known As: N-(((3-Chlorophenyl)azo)(3,4-dimethoxyphenyl)methylene)-4-phenyl-1-piperazinamine, 1-Piperazinamine, N-(((3-chlorophenyl)azo)(3,4-dimethoxyphenyl)methylene)-4-phenyl-, BRN 4216093
| Molecular Formula | C25H26ClN5O2 |
|---|---|
| Molecular Weight | 463.18 g/mol |
| LogP | 5.6249 |
| Topological Polar Surface Area | 62.02 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 463.1775 |
| Heavy Atoms | 33 |
| Complexity | 1128.651 |
Chemical Identifiers
| CAS Number | 127718-41-6 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)/C(=N/N2CCN(CC2)C3=CC=CC=C3)/N=NC4=CC(=CC=C4)Cl)OC |
Product Overview
BRN 4216093 (CAS 127718-41-6), with molecular formula C25H26ClN5O2 and molecular weight 463.18 g/mol. IUPAC: N-(3-chlorophenyl)imino-3,4-dimethoxy-N'-(4-phenylpiperazin-1-yl)benzenecarboximidamide.
Chemical Property Profile of BRN 4216093
Property Insights of BRN 4216093
The XLogP value of 5.6249 indicates that BRN 4216093 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.02 Ų falls within the moderate polarity range, balancing permeability and solubility for BRN 4216093. Following Lipinski's Rule of Five, BRN 4216093 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BRN 4216093?
The CAS number of BRN 4216093 is 127718-41-6.
What is the molecular formula of BRN 4216093?
The molecular formula of BRN 4216093 is C25H26ClN5O2.
What is the molecular weight of BRN 4216093?
The molecular weight of BRN 4216093 is 463.18 g/mol.
Where can I buy BRN 4216093?
You can request a quote for BRN 4216093 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BRN 4216093?
Yes, KEHONG BIO provides custom synthesis services for BRN 4216093 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.