S-(Tetrahydro-1,1-dioxido-3-thienyl) ethanethioate
TL;DR: S-(Tetrahydro-1,1-dioxido-3-thienyl) ethanethioate (CAS 201990-25-2) is a chemical compound with molecular formula C6H10O3S2 and molecular weight 194.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
S-(1,1-dioxothiolan-3-yl) ethanethioate
Also Known As: S-(1,1-dioxothiolan-3-yl) ethanethioate, S-(1,1-Dioxothiolan-3-yl)ethanethioate, IDI1_007176, S-(Tetrahydro-1,1-dioxido-3-thienyl) ethanethioate, 3-(ACETYLSULFANYL)-1??-THIOLANE-1,1-DIONE
| Molecular Formula | C6H10O3S2 |
|---|---|
| Molecular Weight | 194.01 g/mol |
| LogP | 0.4532 |
| Topological Polar Surface Area | 51.21 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 194.00714 |
| Heavy Atoms | 11 |
| Complexity | 255.00096 |
Chemical Identifiers
| CAS Number | 201990-25-2 |
|---|---|
| SMILES | CC(=O)SC1CCS(=O)(=O)C1 |
Product Overview
S-(Tetrahydro-1,1-dioxido-3-thienyl) ethanethioate (CAS 201990-25-2), with molecular formula C6H10O3S2 and molecular weight 194.01 g/mol. IUPAC: S-(1,1-dioxothiolan-3-yl) ethanethioate.
Chemical Property Profile of S-(Tetrahydro-1,1-dioxido-3-thienyl) ethanethioate
Property Insights of S-(Tetrahydro-1,1-dioxido-3-thienyl) ethanethioate
The XLogP value of 0.4532 suggests moderate lipophilicity, balancing water solubility and membrane permeability for S-(Tetrahydro-1,1-dioxido-3-thienyl) ethanethioate. With a topological polar surface area (TPSA) of 51.21 Ų, S-(Tetrahydro-1,1-dioxido-3-thienyl) ethanethioate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, S-(Tetrahydro-1,1-dioxido-3-thienyl) ethanethioate has 0 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 S-(Tetrahydro-1,1-dioxido-3-thienyl) ethanethioate?
The CAS number of S-(Tetrahydro-1,1-dioxido-3-thienyl) ethanethioate is 201990-25-2.
What is the molecular formula of S-(Tetrahydro-1,1-dioxido-3-thienyl) ethanethioate?
The molecular formula of S-(Tetrahydro-1,1-dioxido-3-thienyl) ethanethioate is C6H10O3S2.
What is the molecular weight of S-(Tetrahydro-1,1-dioxido-3-thienyl) ethanethioate?
The molecular weight of S-(Tetrahydro-1,1-dioxido-3-thienyl) ethanethioate is 194.01 g/mol.
Where can I buy S-(Tetrahydro-1,1-dioxido-3-thienyl) ethanethioate?
You can request a quote for S-(Tetrahydro-1,1-dioxido-3-thienyl) ethanethioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for S-(Tetrahydro-1,1-dioxido-3-thienyl) ethanethioate?
Yes, KEHONG BIO provides custom synthesis services for S-(Tetrahydro-1,1-dioxido-3-thienyl) ethanethioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.