Thiazinamium Metilsulfate
TL;DR: Thiazinamium Metilsulfate (CAS 58-34-4) is a chemical compound with molecular formula C19H26N2O4S2 and molecular weight 410.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl sulfate;trimethyl(1-phenothiazin-10-ylpropan-2-yl)azanium
Also Known As: Thiazinamium metilsulfate, Multergan, Multezin, Padisal, Valan
| Molecular Formula | C19H26N2O4S2 |
|---|---|
| Molecular Weight | 410.13 g/mol |
| LogP | 3.48 |
| Topological Polar Surface Area | 103.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 410.1334 |
| Heavy Atoms | 27 |
| Complexity | 420.0 |
Chemical Identifiers
| CAS Number | 58-34-4 |
|---|---|
| SMILES | CC(CN1C2=CC=CC=C2SC3=CC=CC=C31)[N+](C)(C)C.COS(=O)(=O)[O-] |
| InChIKey | BVIDQAVCCRUFGU-UHFFFAOYSA-M |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Thiazinamium Metilsulfate (CAS 58-34-4), with molecular formula C19H26N2O4S2 and molecular weight 410.13 g/mol. IUPAC: methyl sulfate;trimethyl(1-phenothiazin-10-ylpropan-2-yl)azanium.
Chemical Property Profile of Thiazinamium Metilsulfate
Property Insights of Thiazinamium Metilsulfate
The XLogP value of 3.48 indicates that Thiazinamium Metilsulfate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 103.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Thiazinamium Metilsulfate. Following Lipinski's Rule of Five, Thiazinamium Metilsulfate has 0 hydrogen bond donor(s) and 6 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 Thiazinamium Metilsulfate?
The CAS number of Thiazinamium Metilsulfate is 58-34-4.
What is the molecular formula of Thiazinamium Metilsulfate?
The molecular formula of Thiazinamium Metilsulfate is C19H26N2O4S2.
What is the molecular weight of Thiazinamium Metilsulfate?
The molecular weight of Thiazinamium Metilsulfate is 410.13 g/mol.
Where can I buy Thiazinamium Metilsulfate?
You can request a quote for Thiazinamium Metilsulfate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Thiazinamium Metilsulfate?
Yes, KEHONG BIO provides custom synthesis services for Thiazinamium Metilsulfate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.