Benz(1,4)oxathiino(2,3-c)pyridine
TL;DR: Benz(1,4)oxathiino(2,3-c)pyridine (CAS 51568-32-2) is a chemical compound with molecular formula C11H7NOS and molecular weight 201.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1,4]benzoxathiino[2,3-c]pyridine
Also Known As: [1,4]Benzoxathiino[2,3-c]pyridine|2-Aza-10-thia-9-oxaanthracene|Benz(1,4)oxathiino(2,3-c)pyridine|[1,4]Benzoxathiino[2,3-c]pyridine #|2-oxa-9-thia-5-azatricyclo[8.4.0.03,8]tetradeca-1(14),3,5,7,10,12-hexaene|HLTVJSOIDKMSPK-UHFFFAOYSA-N
| Molecular Formula | C11H7NOS |
|---|---|
| Molecular Weight | 201.02 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 47.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 201.02484 |
| Heavy Atoms | 14 |
| Complexity | 211.0 |
Chemical Identifiers
| CAS Number | 51568-32-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)OC3=C(S2)C=CN=C3 |
| InChIKey | HLTVJSOIDKMSPK-UHFFFAOYSA-N |
Product Overview
Benz(1,4)oxathiino(2,3-c)pyridine (CAS 51568-32-2), with molecular formula C11H7NOS and molecular weight 201.02 g/mol. IUPAC: [1,4]benzoxathiino[2,3-c]pyridine.
Chemical Property Profile of Benz(1,4)oxathiino(2,3-c)pyridine
Property Insights of Benz(1,4)oxathiino(2,3-c)pyridine
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benz(1,4)oxathiino(2,3-c)pyridine. With a topological polar surface area (TPSA) of 47.4 Ų, Benz(1,4)oxathiino(2,3-c)pyridine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benz(1,4)oxathiino(2,3-c)pyridine 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 Benz(1,4)oxathiino(2,3-c)pyridine?
The CAS number of Benz(1,4)oxathiino(2,3-c)pyridine is 51568-32-2.
What is the molecular formula of Benz(1,4)oxathiino(2,3-c)pyridine?
The molecular formula of Benz(1,4)oxathiino(2,3-c)pyridine is C11H7NOS.
What is the molecular weight of Benz(1,4)oxathiino(2,3-c)pyridine?
The molecular weight of Benz(1,4)oxathiino(2,3-c)pyridine is 201.02 g/mol.
Where can I buy Benz(1,4)oxathiino(2,3-c)pyridine?
You can request a quote for Benz(1,4)oxathiino(2,3-c)pyridine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benz(1,4)oxathiino(2,3-c)pyridine?
Yes, KEHONG BIO provides custom synthesis services for Benz(1,4)oxathiino(2,3-c)pyridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.