2,6-Dimethoxy-4-(morpholin-4-ylcarbonothioyl)phenyl 4-fluorobenzoate
TL;DR: 2,6-Dimethoxy-4-(morpholin-4-ylcarbonothioyl)phenyl 4-fluorobenzoate (CAS 443896-76-2) is a chemical compound with molecular formula C20H20FNO5S and molecular weight 405.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2,6-dimethoxy-4-(morpholine-4-carbothioyl)phenyl] 4-fluorobenzoate
Also Known As: 2,6-dimethoxy-4-(morpholin-4-ylcarbonothioyl)phenyl 4-fluorobenzoate, [2,6-dimethoxy-4-(morpholine-4-carbothioyl)phenyl] 4-fluorobenzoate, 2,6-dimethoxy-4-(morpholine-4-carbonothioyl)phenyl 4-fluorobenzoate
| Molecular Formula | C20H20FNO5S |
|---|---|
| Molecular Weight | 405.10 g/mol |
| LogP | 3.0698 |
| Topological Polar Surface Area | 57.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 405.1046 |
| Heavy Atoms | 28 |
| Complexity | 840.3949 |
Chemical Identifiers
| CAS Number | 443896-76-2 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC(=O)C2=CC=C(C=C2)F)OC)C(=S)N3CCOCC3 |
Product Overview
2,6-Dimethoxy-4-(morpholin-4-ylcarbonothioyl)phenyl 4-fluorobenzoate (CAS 443896-76-2), with molecular formula C20H20FNO5S and molecular weight 405.10 g/mol. IUPAC: [2,6-dimethoxy-4-(morpholine-4-carbothioyl)phenyl] 4-fluorobenzoate.
Chemical Property Profile of 2,6-Dimethoxy-4-(morpholin-4-ylcarbonothioyl)phenyl 4-fluorobenzoate
Property Insights of 2,6-Dimethoxy-4-(morpholin-4-ylcarbonothioyl)phenyl 4-fluorobenzoate
The XLogP value of 3.0698 indicates that 2,6-Dimethoxy-4-(morpholin-4-ylcarbonothioyl)phenyl 4-fluorobenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.23 Ų, 2,6-Dimethoxy-4-(morpholin-4-ylcarbonothioyl)phenyl 4-fluorobenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,6-Dimethoxy-4-(morpholin-4-ylcarbonothioyl)phenyl 4-fluorobenzoate 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 2,6-Dimethoxy-4-(morpholin-4-ylcarbonothioyl)phenyl 4-fluorobenzoate?
The CAS number of 2,6-Dimethoxy-4-(morpholin-4-ylcarbonothioyl)phenyl 4-fluorobenzoate is 443896-76-2.
What is the molecular formula of 2,6-Dimethoxy-4-(morpholin-4-ylcarbonothioyl)phenyl 4-fluorobenzoate?
The molecular formula of 2,6-Dimethoxy-4-(morpholin-4-ylcarbonothioyl)phenyl 4-fluorobenzoate is C20H20FNO5S.
What is the molecular weight of 2,6-Dimethoxy-4-(morpholin-4-ylcarbonothioyl)phenyl 4-fluorobenzoate?
The molecular weight of 2,6-Dimethoxy-4-(morpholin-4-ylcarbonothioyl)phenyl 4-fluorobenzoate is 405.10 g/mol.
Where can I buy 2,6-Dimethoxy-4-(morpholin-4-ylcarbonothioyl)phenyl 4-fluorobenzoate?
You can request a quote for 2,6-Dimethoxy-4-(morpholin-4-ylcarbonothioyl)phenyl 4-fluorobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,6-Dimethoxy-4-(morpholin-4-ylcarbonothioyl)phenyl 4-fluorobenzoate?
Yes, KEHONG BIO provides custom synthesis services for 2,6-Dimethoxy-4-(morpholin-4-ylcarbonothioyl)phenyl 4-fluorobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.