Oxafun
TL;DR: Oxafun (CAS 37244-87-4) is a chemical compound with molecular formula C18H25N3O2S5 and molecular weight 475.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethylcarbamothioylsulfanyl N,N-dimethylcarbamodithioate;6-methyl-N-phenyl-2,3-dihydro-1,4-oxathiine-5-carboxamide
Also Known As: Oxafun, Tiroxine, 2-methyl-n-phenyl-5,6-dihydro-1,4-oxathiine-3-carboxamide-[disulfanediylbis(carbonothioylnitrilo)]tetramethane(1:1), dimethylcarbamothioylsulfanyl N,N-dimethylcarbamodithioate;6-methyl-N-phenyl-2,3-dihydro-1,4-oxathiine-5-carboxamide, 1,4-Oxathiin-3-carboxamide, 5,6-dihydro-2-methyl-N-phenyl-, mixt. with 1,1',1'',1'''-[dithiobis(carbonothioylnitrilo)]tetrakis[methane]
| Molecular Formula | C18H25N3O2S5 |
|---|---|
| Molecular Weight | 475.06 g/mol |
| LogP | 4.68 |
| Topological Polar Surface Area | 185.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 475.05502 |
| Heavy Atoms | 28 |
| Complexity | 454.0 |
Chemical Identifiers
| CAS Number | 37244-87-4 |
|---|---|
| SMILES | CC1=C(SCCO1)C(=O)NC2=CC=CC=C2.CN(C)C(=S)SSC(=S)N(C)C |
| InChIKey | FCBNNTXINJPXSP-UHFFFAOYSA-N |
Product Overview
Oxafun (CAS 37244-87-4), with molecular formula C18H25N3O2S5 and molecular weight 475.06 g/mol. IUPAC: dimethylcarbamothioylsulfanyl N,N-dimethylcarbamodithioate;6-methyl-N-phenyl-2,3-dihydro-1,4-oxathiine-5-carboxamide.
Chemical Property Profile of Oxafun
Property Insights of Oxafun
The XLogP value of 4.68 indicates that Oxafun is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 185.0 Ų indicates high polarity, suggesting Oxafun may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Oxafun has 1 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 Oxafun?
The CAS number of Oxafun is 37244-87-4.
What is the molecular formula of Oxafun?
The molecular formula of Oxafun is C18H25N3O2S5.
What is the molecular weight of Oxafun?
The molecular weight of Oxafun is 475.06 g/mol.
Where can I buy Oxafun?
You can request a quote for Oxafun directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Oxafun?
Yes, KEHONG BIO provides custom synthesis services for Oxafun and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.