Melarsen oxide
TL;DR: Melarsen oxide (CAS 21840-08-4) is a chemical compound with molecular formula C9H9AsN6O and molecular weight 292.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-N-(4-arsorosophenyl)-1,3,5-triazine-2,4,6-triamine
Also Known As: Melarsen oxide, Melarsenoxyd, Melox, melarsenoxide, Malarsen oxide
| Molecular Formula | C9H9AsN6O |
|---|---|
| Molecular Weight | 292.01 g/mol |
| LogP | -0.55 |
| Topological Polar Surface Area | 120.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 292.00537 |
| Heavy Atoms | 17 |
| Complexity | 250.0 |
Chemical Identifiers
| CAS Number | 21840-08-4 |
|---|---|
| SMILES | C1=CC(=CC=C1NC2=NC(=NC(=N2)N)N)[As]=O |
| InChIKey | YDKGKLBKFOIXPU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Melarsen oxide (CAS 21840-08-4), with molecular formula C9H9AsN6O and molecular weight 292.01 g/mol. IUPAC: 2-N-(4-arsorosophenyl)-1,3,5-triazine-2,4,6-triamine.
Chemical Property Profile of Melarsen oxide
Property Insights of Melarsen oxide
The XLogP value of -0.55 indicates that Melarsen oxide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 120.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Melarsen oxide. Following Lipinski's Rule of Five, Melarsen oxide has 3 hydrogen bond donor(s) and 7 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 Melarsen oxide?
The CAS number of Melarsen oxide is 21840-08-4.
What is the molecular formula of Melarsen oxide?
The molecular formula of Melarsen oxide is C9H9AsN6O.
What is the molecular weight of Melarsen oxide?
The molecular weight of Melarsen oxide is 292.01 g/mol.
Where can I buy Melarsen oxide?
You can request a quote for Melarsen oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Melarsen oxide?
Yes, KEHONG BIO provides custom synthesis services for Melarsen oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.