S-phenyl 3-hydroxy-2-phenylpropanethioate
TL;DR: S-phenyl 3-hydroxy-2-phenylpropanethioate (CAS 41823-07-8) is a chemical compound with molecular formula C15H14O2S and molecular weight 258.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
S-phenyl 3-hydroxy-2-phenylpropanethioate
Also Known As: S-phenyl 3-hydroxy-2-phenylpropanethioate, RefChem:379576
| Molecular Formula | C15H14O2S |
|---|---|
| Molecular Weight | 258.07 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 62.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 258.07144 |
| Heavy Atoms | 18 |
| Complexity | 255.0 |
Chemical Identifiers
| CAS Number | 41823-07-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(CO)C(=O)SC2=CC=CC=C2 |
| InChIKey | XMQVLUDVYLTKOQ-UHFFFAOYSA-N |
Product Overview
S-phenyl 3-hydroxy-2-phenylpropanethioate (CAS 41823-07-8), with molecular formula C15H14O2S and molecular weight 258.07 g/mol. IUPAC: S-phenyl 3-hydroxy-2-phenylpropanethioate.
Chemical Property Profile of S-phenyl 3-hydroxy-2-phenylpropanethioate
Property Insights of S-phenyl 3-hydroxy-2-phenylpropanethioate
The XLogP value of 3.2 indicates that S-phenyl 3-hydroxy-2-phenylpropanethioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.6 Ų falls within the moderate polarity range, balancing permeability and solubility for S-phenyl 3-hydroxy-2-phenylpropanethioate. Following Lipinski's Rule of Five, S-phenyl 3-hydroxy-2-phenylpropanethioate has 1 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 S-phenyl 3-hydroxy-2-phenylpropanethioate?
The CAS number of S-phenyl 3-hydroxy-2-phenylpropanethioate is 41823-07-8.
What is the molecular formula of S-phenyl 3-hydroxy-2-phenylpropanethioate?
The molecular formula of S-phenyl 3-hydroxy-2-phenylpropanethioate is C15H14O2S.
What is the molecular weight of S-phenyl 3-hydroxy-2-phenylpropanethioate?
The molecular weight of S-phenyl 3-hydroxy-2-phenylpropanethioate is 258.07 g/mol.
Where can I buy S-phenyl 3-hydroxy-2-phenylpropanethioate?
You can request a quote for S-phenyl 3-hydroxy-2-phenylpropanethioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for S-phenyl 3-hydroxy-2-phenylpropanethioate?
Yes, KEHONG BIO provides custom synthesis services for S-phenyl 3-hydroxy-2-phenylpropanethioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.