2-Oxo-1,2-diphenylethyl 2-sulfanylbenzoate
TL;DR: 2-Oxo-1,2-diphenylethyl 2-sulfanylbenzoate (CAS 355392-08-4) is a chemical compound with molecular formula C21H16O3S and molecular weight 348.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-oxo-1,2-diphenylethyl) 2-sulfanylbenzoate
Also Known As: 2-oxo-1,2-diphenylethyl 2-sulfanylbenzoate, 2-oxo-1,2-diphenylethyl 2-mercaptobenzoate, (2-oxo-1,2-diphenylethyl) 2-sulfanylbenzoate, (2-oxo-1,2-diphenyl-ethyl) 2-sulfanylbenzoate
| Molecular Formula | C21H16O3S |
|---|---|
| Molecular Weight | 348.08 g/mol |
| LogP | 4.7563 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 348.082 |
| Heavy Atoms | 25 |
| Complexity | 875.9126 |
Chemical Identifiers
| CAS Number | 355392-08-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(C(=O)C2=CC=CC=C2)OC(=O)C3=CC=CC=C3S |
Product Overview
2-Oxo-1,2-diphenylethyl 2-sulfanylbenzoate (CAS 355392-08-4), with molecular formula C21H16O3S and molecular weight 348.08 g/mol. IUPAC: (2-oxo-1,2-diphenylethyl) 2-sulfanylbenzoate.
Chemical Property Profile of 2-Oxo-1,2-diphenylethyl 2-sulfanylbenzoate
Property Insights of 2-Oxo-1,2-diphenylethyl 2-sulfanylbenzoate
The XLogP value of 4.7563 indicates that 2-Oxo-1,2-diphenylethyl 2-sulfanylbenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.37 Ų, 2-Oxo-1,2-diphenylethyl 2-sulfanylbenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Oxo-1,2-diphenylethyl 2-sulfanylbenzoate has 1 hydrogen bond donor(s) and 4 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-Oxo-1,2-diphenylethyl 2-sulfanylbenzoate?
The CAS number of 2-Oxo-1,2-diphenylethyl 2-sulfanylbenzoate is 355392-08-4.
What is the molecular formula of 2-Oxo-1,2-diphenylethyl 2-sulfanylbenzoate?
The molecular formula of 2-Oxo-1,2-diphenylethyl 2-sulfanylbenzoate is C21H16O3S.
What is the molecular weight of 2-Oxo-1,2-diphenylethyl 2-sulfanylbenzoate?
The molecular weight of 2-Oxo-1,2-diphenylethyl 2-sulfanylbenzoate is 348.08 g/mol.
Where can I buy 2-Oxo-1,2-diphenylethyl 2-sulfanylbenzoate?
You can request a quote for 2-Oxo-1,2-diphenylethyl 2-sulfanylbenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Oxo-1,2-diphenylethyl 2-sulfanylbenzoate?
Yes, KEHONG BIO provides custom synthesis services for 2-Oxo-1,2-diphenylethyl 2-sulfanylbenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.