Ethyl phenedium
TL;DR: Ethyl phenedium (CAS 79298-97-8) is a chemical compound with molecular formula C21H20N3+ and molecular weight 314.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(4-aminophenyl)-5-ethylphenanthridin-5-ium-8-amine
Also Known As: Ethyl phenedium, Ethyl phenidium, Phenanthridinium, 8-amino-6-(4-aminophenyl)-5-ethyl-, 6-(4-aminophenyl)-5-ethylphenanthridin-5-ium-8-amine, 1-(3,4-dichlorophenyl)-2-(dipentylamino)ethanol
| Molecular Formula | C21H20N3+ |
|---|---|
| Molecular Weight | 314.17 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 55.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 314.1657 |
| Heavy Atoms | 24 |
| Complexity | 417.0 |
Chemical Identifiers
| CAS Number | 79298-97-8 |
|---|---|
| SMILES | CC[N+]1=C(C2=C(C=CC(=C2)N)C3=CC=CC=C31)C4=CC=C(C=C4)N |
| InChIKey | QXFACCRPTJPLRO-UHFFFAOYSA-O |
Product Overview
Ethyl phenedium (CAS 79298-97-8), with molecular formula C21H20N3+ and molecular weight 314.17 g/mol. IUPAC: 6-(4-aminophenyl)-5-ethylphenanthridin-5-ium-8-amine.
Chemical Property Profile of Ethyl phenedium
Property Insights of Ethyl phenedium
The XLogP value of 4.2 indicates that Ethyl phenedium is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.9 Ų, Ethyl phenedium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl phenedium has 2 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 Ethyl phenedium?
The CAS number of Ethyl phenedium is 79298-97-8.
What is the molecular formula of Ethyl phenedium?
The molecular formula of Ethyl phenedium is C21H20N3+.
What is the molecular weight of Ethyl phenedium?
The molecular weight of Ethyl phenedium is 314.17 g/mol.
Where can I buy Ethyl phenedium?
You can request a quote for Ethyl phenedium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl phenedium?
Yes, KEHONG BIO provides custom synthesis services for Ethyl phenedium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.