盐酸二甲氧酯
TL;DR: 盐酸二甲氧酯 (CAS 518-63-8) is a chemical compound with molecular formula C19H23ClN2O3S and molecular weight 394.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
盐酸二甲氧酯
2-[2-(dimethylamino)ethoxy]ethyl phenothiazine-10-carboxylate;hydrochloride
Also Known As: Tussizid, Perlatos, DIMETHOXANATE HYDROCHLORIDE, Catrane, Cothera
| Molecular Formula | C19H23ClN2O3S |
|---|---|
| Molecular Weight | 394.11 g/mol |
| LogP | 4.43 |
| Topological Polar Surface Area | 67.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 394.1118 |
| Heavy Atoms | 26 |
| Complexity | 413.0 |
Chemical Identifiers
| CAS Number | 518-63-8 |
|---|---|
| SMILES | CN(C)CCOCCOC(=O)N1C2=CC=CC=C2SC3=CC=CC=C31.Cl |
| InChIKey | ZJRHNNNACBPWEB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
盐酸二甲氧酯 (CAS 518-63-8), with molecular formula C19H23ClN2O3S and molecular weight 394.11 g/mol. IUPAC: 2-[2-(dimethylamino)ethoxy]ethyl phenothiazine-10-carboxylate;hydrochloride.
Chemical Property Profile of 盐酸二甲氧酯
Property Insights of 盐酸二甲氧酯
The XLogP value of 4.43 indicates that 盐酸二甲氧酯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 盐酸二甲氧酯. Following Lipinski's Rule of Five, 盐酸二甲氧酯 has 1 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 盐酸二甲氧酯?
The CAS number of 盐酸二甲氧酯 is 518-63-8.
What is the molecular formula of 盐酸二甲氧酯?
The molecular formula of 盐酸二甲氧酯 is C19H23ClN2O3S.
What is the molecular weight of 盐酸二甲氧酯?
The molecular weight of 盐酸二甲氧酯 is 394.11 g/mol.
Where can I buy 盐酸二甲氧酯?
You can request a quote for 盐酸二甲氧酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 盐酸二甲氧酯?
Yes, KEHONG BIO provides custom synthesis services for 盐酸二甲氧酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.