4H-Thiopyran
TL;DR: 4H-Thiopyran (CAS 29822-02-4) is a chemical compound with molecular formula C1C=CSC=C1 and molecular weight 98.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4H-thiopyran
Also Known As: 4H-Thiopyran, RefChem:297975
| Molecular Formula | C1C=CSC=C1 |
|---|---|
| Molecular Weight | 98.02 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 25.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 98.01902 |
| Heavy Atoms | 6 |
| Complexity | 71.0 |
Chemical Identifiers
| CAS Number | 29822-02-4 |
|---|---|
| SMILES | C1C=CSC=C1 |
| InChIKey | STBGWNRZMPCVTG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4H-Thiopyran (CAS 29822-02-4), with molecular formula C1C=CSC=C1 and molecular weight 98.02 g/mol. IUPAC: 4H-thiopyran.
Chemical Property Profile of 4H-Thiopyran
Property Insights of 4H-Thiopyran
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4H-Thiopyran. With a topological polar surface area (TPSA) of 25.3 Ų, 4H-Thiopyran exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4H-Thiopyran has 0 hydrogen bond donor(s) and 1 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 4H-Thiopyran?
The CAS number of 4H-Thiopyran is 29822-02-4.
What is the molecular formula of 4H-Thiopyran?
The molecular formula of 4H-Thiopyran is C1C=CSC=C1.
What is the molecular weight of 4H-Thiopyran?
The molecular weight of 4H-Thiopyran is 98.02 g/mol.
Where can I buy 4H-Thiopyran?
You can request a quote for 4H-Thiopyran directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4H-Thiopyran?
Yes, KEHONG BIO provides custom synthesis services for 4H-Thiopyran and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.