Diethyl(3H-1-ethoxy-3-phenoxazinylidene)ammonium chloride
TL;DR: Diethyl(3H-1-ethoxy-3-phenoxazinylidene)ammonium chloride (CAS 23964-37-6) is a chemical compound with molecular formula C22H30ClN3O2 and molecular weight 403.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[7-(diethylamino)-9-ethoxyphenoxazin-3-ylidene]-diethylazanium chloride
Also Known As: Genacryl Blue 3G, C.I. Basic Blue 3, Diethyl(3H-1-ethoxy-3-phenoxazinylidene)ammonium chloride, Phenoxazin-5-ium, 3,7-bis(diethylamino)-1-ethoxy-, chloride, 3,7-Bis(diethylamino)-1-ethoxyphenoxazin-5-ium chloride
| Molecular Formula | C22H30ClN3O2 |
|---|---|
| Molecular Weight | 403.20 g/mol |
| LogP | 0.9935 |
| Topological Polar Surface Area | 37.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 403.20267 |
| Heavy Atoms | 28 |
| Complexity | 640.0 |
Chemical Identifiers
| CAS Number | 23964-37-6 |
|---|---|
| SMILES | CCN(CC)C1=CC2=C(C(=C1)OCC)N=C3C=CC(=[N+](CC)CC)C=C3O2.[Cl-] |
| InChIKey | JPNWXFHXHDCQJE-UHFFFAOYSA-M |
Product Overview
Diethyl(3H-1-ethoxy-3-phenoxazinylidene)ammonium chloride (CAS 23964-37-6), with molecular formula C22H30ClN3O2 and molecular weight 403.20 g/mol. IUPAC: [7-(diethylamino)-9-ethoxyphenoxazin-3-ylidene]-diethylazanium chloride.
Chemical Property Profile of Diethyl(3H-1-ethoxy-3-phenoxazinylidene)ammonium chloride
Property Insights of Diethyl(3H-1-ethoxy-3-phenoxazinylidene)ammonium chloride
The XLogP value of 0.9935 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diethyl(3H-1-ethoxy-3-phenoxazinylidene)ammonium chloride. With a topological polar surface area (TPSA) of 37.1 Ų, Diethyl(3H-1-ethoxy-3-phenoxazinylidene)ammonium chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Diethyl(3H-1-ethoxy-3-phenoxazinylidene)ammonium chloride has 0 hydrogen bond donor(s) and 5 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 Diethyl(3H-1-ethoxy-3-phenoxazinylidene)ammonium chloride?
The CAS number of Diethyl(3H-1-ethoxy-3-phenoxazinylidene)ammonium chloride is 23964-37-6.
What is the molecular formula of Diethyl(3H-1-ethoxy-3-phenoxazinylidene)ammonium chloride?
The molecular formula of Diethyl(3H-1-ethoxy-3-phenoxazinylidene)ammonium chloride is C22H30ClN3O2.
What is the molecular weight of Diethyl(3H-1-ethoxy-3-phenoxazinylidene)ammonium chloride?
The molecular weight of Diethyl(3H-1-ethoxy-3-phenoxazinylidene)ammonium chloride is 403.20 g/mol.
Where can I buy Diethyl(3H-1-ethoxy-3-phenoxazinylidene)ammonium chloride?
You can request a quote for Diethyl(3H-1-ethoxy-3-phenoxazinylidene)ammonium chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl(3H-1-ethoxy-3-phenoxazinylidene)ammonium chloride?
Yes, KEHONG BIO provides custom synthesis services for Diethyl(3H-1-ethoxy-3-phenoxazinylidene)ammonium chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.