Acetic acid, (2,6-dimethoxy-4-(4-morpholinylthioxomethyl)phenoxy)-, ethyl ester
TL;DR: Acetic acid, (2,6-dimethoxy-4-(4-morpholinylthioxomethyl)phenoxy)-, ethyl ester (CAS 70733-93-6) is a chemical compound with molecular formula C17H23NO6S and molecular weight 369.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[2,6-dimethoxy-4-(morpholine-4-carbothioyl)phenoxy]acetate
Also Known As: 4-(3,5-Dimethoxy-4-ethoxycarbonylmethoxythiobenzoyl)morpholine, Acetic acid, (2,6-dimethoxy-4-(4-morpholinylthioxomethyl)phenoxy)-, ethyl ester, Ethyl (2,6-dimethoxy-4-(4-morpholinylthioxomethyl)phenoxy)acetate, ACETIC ACID, (4-MORPHOLINOTHIOCARBONYL-2,6-DIMETHOXYPHENOXY)-, ETHYL ESTER, ethyl 2-[2,6-dimethoxy-4-(morpholine-4-carbothioyl)phenoxy]acetate
| Molecular Formula | C17H23NO6S |
|---|---|
| Molecular Weight | 369.12 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 98.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 369.1246 |
| Heavy Atoms | 25 |
| Complexity | 429.0 |
Chemical Identifiers
| CAS Number | 70733-93-6 |
|---|---|
| SMILES | CCOC(=O)COC1=C(C=C(C=C1OC)C(=S)N2CCOCC2)OC |
| InChIKey | NPIWJYYJVKKKJV-UHFFFAOYSA-N |
Product Overview
Acetic acid, (2,6-dimethoxy-4-(4-morpholinylthioxomethyl)phenoxy)-, ethyl ester (CAS 70733-93-6), with molecular formula C17H23NO6S and molecular weight 369.12 g/mol. IUPAC: ethyl 2-[2,6-dimethoxy-4-(morpholine-4-carbothioyl)phenoxy]acetate.
Chemical Property Profile of Acetic acid, (2,6-dimethoxy-4-(4-morpholinylthioxomethyl)phenoxy)-, ethyl ester
Property Insights of Acetic acid, (2,6-dimethoxy-4-(4-morpholinylthioxomethyl)phenoxy)-, ethyl ester
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetic acid, (2,6-dimethoxy-4-(4-morpholinylthioxomethyl)phenoxy)-, ethyl ester. The TPSA of 98.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Acetic acid, (2,6-dimethoxy-4-(4-morpholinylthioxomethyl)phenoxy)-, ethyl ester. Following Lipinski's Rule of Five, Acetic acid, (2,6-dimethoxy-4-(4-morpholinylthioxomethyl)phenoxy)-, ethyl ester has 0 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 Acetic acid, (2,6-dimethoxy-4-(4-morpholinylthioxomethyl)phenoxy)-, ethyl ester?
The CAS number of Acetic acid, (2,6-dimethoxy-4-(4-morpholinylthioxomethyl)phenoxy)-, ethyl ester is 70733-93-6.
What is the molecular formula of Acetic acid, (2,6-dimethoxy-4-(4-morpholinylthioxomethyl)phenoxy)-, ethyl ester?
The molecular formula of Acetic acid, (2,6-dimethoxy-4-(4-morpholinylthioxomethyl)phenoxy)-, ethyl ester is C17H23NO6S.
What is the molecular weight of Acetic acid, (2,6-dimethoxy-4-(4-morpholinylthioxomethyl)phenoxy)-, ethyl ester?
The molecular weight of Acetic acid, (2,6-dimethoxy-4-(4-morpholinylthioxomethyl)phenoxy)-, ethyl ester is 369.12 g/mol.
Where can I buy Acetic acid, (2,6-dimethoxy-4-(4-morpholinylthioxomethyl)phenoxy)-, ethyl ester?
You can request a quote for Acetic acid, (2,6-dimethoxy-4-(4-morpholinylthioxomethyl)phenoxy)-, ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetic acid, (2,6-dimethoxy-4-(4-morpholinylthioxomethyl)phenoxy)-, ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Acetic acid, (2,6-dimethoxy-4-(4-morpholinylthioxomethyl)phenoxy)-, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.