1,3-Oxathiole-2-thione, 4,5-diphenyl-
TL;DR: 1,3-Oxathiole-2-thione, 4,5-diphenyl- (CAS 54199-62-1) is a chemical compound with molecular formula C15H10OS2 and molecular weight 270.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,5-diphenyl-1,3-oxathiole-2-thione
Also Known As: 4,5-Diphenyl-1,3-oxathiole-2-thione, diphenyl-2H-1,3-oxathiole-2-thione, 1,3-Oxathiole-2-thione, 4,5-diphenyl-, 4,5-Diphenyl-1,3-oxathiole-2-thione #
| Molecular Formula | C15H10OS2 |
|---|---|
| Molecular Weight | 270.02 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 66.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 270.0173 |
| Heavy Atoms | 18 |
| Complexity | 350.0 |
Chemical Identifiers
| CAS Number | 54199-62-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=C(SC(=S)O2)C3=CC=CC=C3 |
| InChIKey | GSZLPXIVYHRRHR-UHFFFAOYSA-N |
Product Overview
1,3-Oxathiole-2-thione, 4,5-diphenyl- (CAS 54199-62-1), with molecular formula C15H10OS2 and molecular weight 270.02 g/mol. IUPAC: 4,5-diphenyl-1,3-oxathiole-2-thione.
Chemical Property Profile of 1,3-Oxathiole-2-thione, 4,5-diphenyl-
Property Insights of 1,3-Oxathiole-2-thione, 4,5-diphenyl-
The XLogP value of 4.7 indicates that 1,3-Oxathiole-2-thione, 4,5-diphenyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-Oxathiole-2-thione, 4,5-diphenyl-. Following Lipinski's Rule of Five, 1,3-Oxathiole-2-thione, 4,5-diphenyl- has 0 hydrogen bond donor(s) and 3 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 1,3-Oxathiole-2-thione, 4,5-diphenyl-?
The CAS number of 1,3-Oxathiole-2-thione, 4,5-diphenyl- is 54199-62-1.
What is the molecular formula of 1,3-Oxathiole-2-thione, 4,5-diphenyl-?
The molecular formula of 1,3-Oxathiole-2-thione, 4,5-diphenyl- is C15H10OS2.
What is the molecular weight of 1,3-Oxathiole-2-thione, 4,5-diphenyl-?
The molecular weight of 1,3-Oxathiole-2-thione, 4,5-diphenyl- is 270.02 g/mol.
Where can I buy 1,3-Oxathiole-2-thione, 4,5-diphenyl-?
You can request a quote for 1,3-Oxathiole-2-thione, 4,5-diphenyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Oxathiole-2-thione, 4,5-diphenyl-?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Oxathiole-2-thione, 4,5-diphenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.