![6,7-dihydro-5H-[1,3]dithiolo[4,5-b][1,4]dithiepin-2-one structure](/static/products/7496/74962-30-4.webp)
6,7-dihydro-5H-[1,3]dithiolo[4,5-b][1,4]dithiepin-2-one
TL;DR: 6,7-dihydro-5H-[1,3]dithiolo[4,5-b][1,4]dithiepin-2-one (CAS 74962-30-4) is a chemical compound with molecular formula C6H6OS4 and molecular weight 221.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6,7-dihydro-5H-[1,3]dithiolo[4,5-b][1,4]dithiepin-2-one
Also Known As: 2,6,8,10-tetrathiabicyclo[5.3.0]dec-11-en-9-one, 6,7-dihydro-5H-[1,3]dithiolo[4,5-b][1,4]dithiepin-2-one, 6,7-Dihydro-5H-1,3-dithiolo[4,5-b][1,4]dithiepin-2-one, 5H,6H,7H-1,3-dithioleno[4,5-b]1,4-dithiepin-2-one, 2H,5H,6H,7H-[1,3]dithiolo[4,5-b][1,4]dithiepin-2-one
| Molecular Formula | C6H6OS4 |
|---|---|
| Molecular Weight | 221.93 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 118.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 221.93015 |
| Heavy Atoms | 11 |
| Complexity | 203.0 |
Chemical Identifiers
| CAS Number | 74962-30-4 |
|---|---|
| SMILES | C1CSC2=C(SC1)SC(=O)S2 |
| InChIKey | PXNCTRSVBUZLSI-UHFFFAOYSA-N |
Product Overview
6,7-dihydro-5H-[1,3]dithiolo[4,5-b][1,4]dithiepin-2-one (CAS 74962-30-4), with molecular formula C6H6OS4 and molecular weight 221.93 g/mol. IUPAC: 6,7-dihydro-5H-[1,3]dithiolo[4,5-b][1,4]dithiepin-2-one.
Chemical Property Profile of 6,7-dihydro-5H-[1,3]dithiolo[4,5-b][1,4]dithiepin-2-one
Property Insights of 6,7-dihydro-5H-[1,3]dithiolo[4,5-b][1,4]dithiepin-2-one
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6,7-dihydro-5H-[1,3]dithiolo[4,5-b][1,4]dithiepin-2-one. The TPSA of 118.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 6,7-dihydro-5H-[1,3]dithiolo[4,5-b][1,4]dithiepin-2-one. Following Lipinski's Rule of Five, 6,7-dihydro-5H-[1,3]dithiolo[4,5-b][1,4]dithiepin-2-one has 0 hydrogen bond donor(s) and 5 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 6,7-dihydro-5H-[1,3]dithiolo[4,5-b][1,4]dithiepin-2-one?
The CAS number of 6,7-dihydro-5H-[1,3]dithiolo[4,5-b][1,4]dithiepin-2-one is 74962-30-4.
What is the molecular formula of 6,7-dihydro-5H-[1,3]dithiolo[4,5-b][1,4]dithiepin-2-one?
The molecular formula of 6,7-dihydro-5H-[1,3]dithiolo[4,5-b][1,4]dithiepin-2-one is C6H6OS4.
What is the molecular weight of 6,7-dihydro-5H-[1,3]dithiolo[4,5-b][1,4]dithiepin-2-one?
The molecular weight of 6,7-dihydro-5H-[1,3]dithiolo[4,5-b][1,4]dithiepin-2-one is 221.93 g/mol.
Where can I buy 6,7-dihydro-5H-[1,3]dithiolo[4,5-b][1,4]dithiepin-2-one?
You can request a quote for 6,7-dihydro-5H-[1,3]dithiolo[4,5-b][1,4]dithiepin-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6,7-dihydro-5H-[1,3]dithiolo[4,5-b][1,4]dithiepin-2-one?
Yes, KEHONG BIO provides custom synthesis services for 6,7-dihydro-5H-[1,3]dithiolo[4,5-b][1,4]dithiepin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.