![4H,6H-Dithieno[3,4-c:3',4'-e]oxepin structure](/static/products/5205/5205-06-1.webp)
4H,6H-Dithieno[3,4-c:3',4'-e]oxepin
TL;DR: 4H,6H-Dithieno[3,4-c:3',4'-e]oxepin (CAS 5205-06-1) is a chemical compound with molecular formula C10H8OS2 and molecular weight 208.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-oxa-4,12-dithiatricyclo[8.3.0.02,6]trideca-1(13),2,5,10-tetraene
Also Known As: 4H,6H-Dithieno[3,4-c:3',4'-e]oxepin, 4H,6H-Dithieno(3,4-c:3',4'-e)oxepin, 4,6-dihydrodithieno[2,3-a:2',3'-d]oxepine, 4,6-Dihydrodithio<3,4-c:3,4-e>oxepin, 4H,6H-Bisthieno[3,4-c:3',4'-e]oxepine
| Molecular Formula | C10H8OS2 |
|---|---|
| Molecular Weight | 208.00 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 65.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 208.00166 |
| Heavy Atoms | 13 |
| Complexity | 177.0 |
Chemical Identifiers
| CAS Number | 5205-06-1 |
|---|---|
| SMILES | C1C2=CSC=C2C3=CSC=C3CO1 |
| InChIKey | LBKKXPSTOSLTSB-UHFFFAOYSA-N |
Product Overview
4H,6H-Dithieno[3,4-c:3',4'-e]oxepin (CAS 5205-06-1), with molecular formula C10H8OS2 and molecular weight 208.00 g/mol. IUPAC: 8-oxa-4,12-dithiatricyclo[8.3.0.02,6]trideca-1(13),2,5,10-tetraene.
Chemical Property Profile of 4H,6H-Dithieno[3,4-c:3',4'-e]oxepin
Property Insights of 4H,6H-Dithieno[3,4-c:3',4'-e]oxepin
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4H,6H-Dithieno[3,4-c:3',4'-e]oxepin. The TPSA of 65.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 4H,6H-Dithieno[3,4-c:3',4'-e]oxepin. Following Lipinski's Rule of Five, 4H,6H-Dithieno[3,4-c:3',4'-e]oxepin 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 4H,6H-Dithieno[3,4-c:3',4'-e]oxepin?
The CAS number of 4H,6H-Dithieno[3,4-c:3',4'-e]oxepin is 5205-06-1.
What is the molecular formula of 4H,6H-Dithieno[3,4-c:3',4'-e]oxepin?
The molecular formula of 4H,6H-Dithieno[3,4-c:3',4'-e]oxepin is C10H8OS2.
What is the molecular weight of 4H,6H-Dithieno[3,4-c:3',4'-e]oxepin?
The molecular weight of 4H,6H-Dithieno[3,4-c:3',4'-e]oxepin is 208.00 g/mol.
Where can I buy 4H,6H-Dithieno[3,4-c:3',4'-e]oxepin?
You can request a quote for 4H,6H-Dithieno[3,4-c:3',4'-e]oxepin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4H,6H-Dithieno[3,4-c:3',4'-e]oxepin?
Yes, KEHONG BIO provides custom synthesis services for 4H,6H-Dithieno[3,4-c:3',4'-e]oxepin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.