RefChem:368589
TL;DR: RefChem:368589 (CAS 4174-65-6) is a chemical compound with molecular formula C28H26Cl2N6 and molecular weight 516.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[2-(5-ethyl-6-phenylphenanthridin-5-ium-8-yl)iminohydrazinyl]benzenecarboximidamide;chloride;hydrochloride
Also Known As: M & B 5853, 8-((m-Amidinophenylazo)amino)-5-ethyl-6-phenylphenanthridinium chloride hydrochloride, Phenanthridinium, 8-(3-(m-amidinophenyl)-2-triazeno)-5-ethyl-6-phenyl-, chloride, hydrochloride, 3-[2-(5-ethyl-6-phenylphenanthridin-5-ium-8-yl)iminohydrazinyl]benzenecarboximidamide chloride hydrochloride, 8-[3-(3-Carbamimidoylphenyl)triaz-2-en-1-yl]-5-ethyl-6-phenylphenanthridin-5-ium chloride--hydrogen chloride (1/1/1)
| Molecular Formula | C28H26Cl2N6 |
|---|---|
| Molecular Weight | 516.16 g/mol |
| LogP | 3.78807 |
| Topological Polar Surface Area | 90.5 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 516.1596 |
| Heavy Atoms | 36 |
| Complexity | 703.0 |
Chemical Identifiers
| CAS Number | 4174-65-6 |
|---|---|
| SMILES | CC[N+]1=C(C2=C(C=CC(=C2)N=NNC3=CC=CC(=C3)C(=N)N)C4=CC=CC=C41)C5=CC=CC=C5.Cl.[Cl-] |
| InChIKey | LUHUWVKOLSCPRJ-UHFFFAOYSA-M |
Product Overview
RefChem:368589 (CAS 4174-65-6), with molecular formula C28H26Cl2N6 and molecular weight 516.16 g/mol. IUPAC: 3-[2-(5-ethyl-6-phenylphenanthridin-5-ium-8-yl)iminohydrazinyl]benzenecarboximidamide;chloride;hydrochloride.
Chemical Property Profile of RefChem:368589
Property Insights of RefChem:368589
The XLogP value of 3.78807 indicates that RefChem:368589 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.5 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:368589. Following Lipinski's Rule of Five, RefChem:368589 has 4 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:368589?
The CAS number of RefChem:368589 is 4174-65-6.
What is the molecular formula of RefChem:368589?
The molecular formula of RefChem:368589 is C28H26Cl2N6.
What is the molecular weight of RefChem:368589?
The molecular weight of RefChem:368589 is 516.16 g/mol.
Where can I buy RefChem:368589?
You can request a quote for RefChem:368589 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:368589?
Yes, KEHONG BIO provides custom synthesis services for RefChem:368589 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.