S-phenyl furan-2-carbothioate
TL;DR: S-phenyl furan-2-carbothioate (CAS 17357-38-9) is a chemical compound with molecular formula C11H8O2S and molecular weight 204.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
S-phenyl furan-2-carbothioate
Also Known As: S-phenyl furan-2-carbothioate, S-Phenyl 2-furanthiocarboxylate, 2-Furoic acid, thio-, S-phenyl ester, Furan-2-carbothioic acid S-phenyl ester, 2-Furoic acid,thio-,S-phenyl ester
| Molecular Formula | C11H8O2S |
|---|---|
| Molecular Weight | 204.02 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 55.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 204.0245 |
| Heavy Atoms | 14 |
| Complexity | 199.0 |
Chemical Identifiers
| CAS Number | 17357-38-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)SC(=O)C2=CC=CO2 |
| InChIKey | XCQROCMQSAUOTM-UHFFFAOYSA-N |
Product Overview
S-phenyl furan-2-carbothioate (CAS 17357-38-9), with molecular formula C11H8O2S and molecular weight 204.02 g/mol. IUPAC: S-phenyl furan-2-carbothioate.
Chemical Property Profile of S-phenyl furan-2-carbothioate
Property Insights of S-phenyl furan-2-carbothioate
The XLogP value of 3.3 indicates that S-phenyl furan-2-carbothioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.5 Ų, S-phenyl furan-2-carbothioate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, S-phenyl furan-2-carbothioate 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 S-phenyl furan-2-carbothioate?
The CAS number of S-phenyl furan-2-carbothioate is 17357-38-9.
What is the molecular formula of S-phenyl furan-2-carbothioate?
The molecular formula of S-phenyl furan-2-carbothioate is C11H8O2S.
What is the molecular weight of S-phenyl furan-2-carbothioate?
The molecular weight of S-phenyl furan-2-carbothioate is 204.02 g/mol.
Where can I buy S-phenyl furan-2-carbothioate?
You can request a quote for S-phenyl furan-2-carbothioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for S-phenyl furan-2-carbothioate?
Yes, KEHONG BIO provides custom synthesis services for S-phenyl furan-2-carbothioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.