1-(Morpholin-4-yl)-2-(3,4,5-trimethoxyphenyl)ethane-1-thione
TL;DR: 1-(Morpholin-4-yl)-2-(3,4,5-trimethoxyphenyl)ethane-1-thione (CAS 64039-00-5) is a chemical compound with molecular formula C15H21NO4S and molecular weight 311.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-morpholin-4-yl-2-(3,4,5-trimethoxyphenyl)ethanethione
Also Known As: 4-[thioacetyl]morpholine, 4-[ thioacetyl]morpholine, Morpholine, 4-((3,4,5-trimethoxyphenyl)thioacetyl), (3,4,5-Trimethoxythiophenylacetyl)morpholin, 1-(morpholin-4-yl)-2-(3,4,5-trimethoxyphenyl)ethanethione
| Molecular Formula | C15H21NO4S |
|---|---|
| Molecular Weight | 311.12 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 72.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 311.11914 |
| Heavy Atoms | 21 |
| Complexity | 322.0 |
Chemical Identifiers
| CAS Number | 64039-00-5 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)CC(=S)N2CCOCC2 |
| InChIKey | GFYDCJTVZXIHOM-UHFFFAOYSA-N |
Product Overview
1-(Morpholin-4-yl)-2-(3,4,5-trimethoxyphenyl)ethane-1-thione (CAS 64039-00-5), with molecular formula C15H21NO4S and molecular weight 311.12 g/mol. IUPAC: 1-morpholin-4-yl-2-(3,4,5-trimethoxyphenyl)ethanethione.
Chemical Property Profile of 1-(Morpholin-4-yl)-2-(3,4,5-trimethoxyphenyl)ethane-1-thione
Property Insights of 1-(Morpholin-4-yl)-2-(3,4,5-trimethoxyphenyl)ethane-1-thione
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(Morpholin-4-yl)-2-(3,4,5-trimethoxyphenyl)ethane-1-thione. The TPSA of 72.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(Morpholin-4-yl)-2-(3,4,5-trimethoxyphenyl)ethane-1-thione. Following Lipinski's Rule of Five, 1-(Morpholin-4-yl)-2-(3,4,5-trimethoxyphenyl)ethane-1-thione has 0 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 1-(Morpholin-4-yl)-2-(3,4,5-trimethoxyphenyl)ethane-1-thione?
The CAS number of 1-(Morpholin-4-yl)-2-(3,4,5-trimethoxyphenyl)ethane-1-thione is 64039-00-5.
What is the molecular formula of 1-(Morpholin-4-yl)-2-(3,4,5-trimethoxyphenyl)ethane-1-thione?
The molecular formula of 1-(Morpholin-4-yl)-2-(3,4,5-trimethoxyphenyl)ethane-1-thione is C15H21NO4S.
What is the molecular weight of 1-(Morpholin-4-yl)-2-(3,4,5-trimethoxyphenyl)ethane-1-thione?
The molecular weight of 1-(Morpholin-4-yl)-2-(3,4,5-trimethoxyphenyl)ethane-1-thione is 311.12 g/mol.
Where can I buy 1-(Morpholin-4-yl)-2-(3,4,5-trimethoxyphenyl)ethane-1-thione?
You can request a quote for 1-(Morpholin-4-yl)-2-(3,4,5-trimethoxyphenyl)ethane-1-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Morpholin-4-yl)-2-(3,4,5-trimethoxyphenyl)ethane-1-thione?
Yes, KEHONG BIO provides custom synthesis services for 1-(Morpholin-4-yl)-2-(3,4,5-trimethoxyphenyl)ethane-1-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.