Einecs 259-070-8
TL;DR: Einecs 259-070-8 (CAS 54290-64-1) is a chemical compound with molecular formula C20H26Cl3N3OZn and molecular weight 493.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
zinc;[7-(diethylamino)phenoxazin-3-ylidene]-diethylazanium;trichloride
Also Known As: EINECS 259-070-8, 3,7-Bis(diethylamino)phenoxazin-5-ium chloride, compound with zincchloride, 3,7-bis(diethylamino)phenoxazin-5-ium chloride, compound with zinc chloride, zinc [7-(diethylamino)phenoxazin-3-ylidene]-diethylazanium trichloride
| Molecular Formula | C20H26Cl3N3OZn |
|---|---|
| Molecular Weight | 493.04 g/mol |
| LogP | -5.3997 |
| Topological Polar Surface Area | 32.28 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 493.04327 |
| Heavy Atoms | 28 |
| Complexity | 891.3732 |
Chemical Identifiers
| CAS Number | 54290-64-1 |
|---|---|
| SMILES | CCN(CC)C1=CC2=C(C=C1)N=C3C=CC(=[N+](CC)CC)C=C3O2.[Cl-].[Cl-].[Cl-].[Zn+2] |
Product Overview
Einecs 259-070-8 (CAS 54290-64-1), with molecular formula C20H26Cl3N3OZn and molecular weight 493.04 g/mol. IUPAC: zinc;[7-(diethylamino)phenoxazin-3-ylidene]-diethylazanium;trichloride.
Chemical Property Profile of Einecs 259-070-8
Property Insights of Einecs 259-070-8
The XLogP value of -5.3997 indicates that Einecs 259-070-8 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 32.28 Ų, Einecs 259-070-8 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Einecs 259-070-8 has 0 hydrogen bond donor(s) and 3 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 Einecs 259-070-8?
The CAS number of Einecs 259-070-8 is 54290-64-1.
What is the molecular formula of Einecs 259-070-8?
The molecular formula of Einecs 259-070-8 is C20H26Cl3N3OZn.
What is the molecular weight of Einecs 259-070-8?
The molecular weight of Einecs 259-070-8 is 493.04 g/mol.
Where can I buy Einecs 259-070-8?
You can request a quote for Einecs 259-070-8 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Einecs 259-070-8?
Yes, KEHONG BIO provides custom synthesis services for Einecs 259-070-8 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.