3H-(1,2)Dithiolo(4,5,1-hi)(1,2)benzodithiole-8-s(iv), 2,6-diethyl-4,5-dihydro-
TL;DR: 3H-(1,2)Dithiolo(4,5,1-hi)(1,2)benzodithiole-8-s(iv), 2,6-diethyl-4,5-dihydro- (CAS 35505-46-5) is a chemical compound with molecular formula C12H16S3 and molecular weight 256.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,6-diethyl-3,4λ4,5-trithiatricyclo[5.3.1.04,11]undeca-1,4(11),6-triene
Also Known As: 3H-(1,2)Dithiolo(4,5,1-hi)(1,2)benzodithiole-8-s(iv), 2,6-diethyl-4,5-dihydro-, 1,4-diethyl-6,7-dihydro-5H-2,2al4,3-trithiacyclopenta[hi]indene, 3H-[1,2]Dithiolo[4,5,1-hi][1,2]benzodithiole-8-S(IV),2,6-diethyl-4,5-dihydro-, 2,6-Diethyl-4,5-dihydro-3H-8lambda~4~-[1,2]dithiolo[4,5,1-hi][1,2]benzodithiole
| Molecular Formula | C12H16S3 |
|---|---|
| Molecular Weight | 256.04 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 69.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 256.0414 |
| Heavy Atoms | 15 |
| Complexity | 377.0 |
Chemical Identifiers
| CAS Number | 35505-46-5 |
|---|---|
| SMILES | CCC1=C2CCCC3=C(SS(=C23)S1)CC |
| InChIKey | IKFANCKGPHGTGJ-UHFFFAOYSA-N |
Product Overview
3H-(1,2)Dithiolo(4,5,1-hi)(1,2)benzodithiole-8-s(iv), 2,6-diethyl-4,5-dihydro- (CAS 35505-46-5), with molecular formula C12H16S3 and molecular weight 256.04 g/mol. IUPAC: 2,6-diethyl-3,4λ4,5-trithiatricyclo[5.3.1.04,11]undeca-1,4(11),6-triene.
Chemical Property Profile of 3H-(1,2)Dithiolo(4,5,1-hi)(1,2)benzodithiole-8-s(iv), 2,6-diethyl-4,5-dihydro-
Property Insights of 3H-(1,2)Dithiolo(4,5,1-hi)(1,2)benzodithiole-8-s(iv), 2,6-diethyl-4,5-dihydro-
The XLogP value of 3.8 indicates that 3H-(1,2)Dithiolo(4,5,1-hi)(1,2)benzodithiole-8-s(iv), 2,6-diethyl-4,5-dihydro- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 3H-(1,2)Dithiolo(4,5,1-hi)(1,2)benzodithiole-8-s(iv), 2,6-diethyl-4,5-dihydro-. Following Lipinski's Rule of Five, 3H-(1,2)Dithiolo(4,5,1-hi)(1,2)benzodithiole-8-s(iv), 2,6-diethyl-4,5-dihydro- 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 3H-(1,2)Dithiolo(4,5,1-hi)(1,2)benzodithiole-8-s(iv), 2,6-diethyl-4,5-dihydro-?
The CAS number of 3H-(1,2)Dithiolo(4,5,1-hi)(1,2)benzodithiole-8-s(iv), 2,6-diethyl-4,5-dihydro- is 35505-46-5.
What is the molecular formula of 3H-(1,2)Dithiolo(4,5,1-hi)(1,2)benzodithiole-8-s(iv), 2,6-diethyl-4,5-dihydro-?
The molecular formula of 3H-(1,2)Dithiolo(4,5,1-hi)(1,2)benzodithiole-8-s(iv), 2,6-diethyl-4,5-dihydro- is C12H16S3.
What is the molecular weight of 3H-(1,2)Dithiolo(4,5,1-hi)(1,2)benzodithiole-8-s(iv), 2,6-diethyl-4,5-dihydro-?
The molecular weight of 3H-(1,2)Dithiolo(4,5,1-hi)(1,2)benzodithiole-8-s(iv), 2,6-diethyl-4,5-dihydro- is 256.04 g/mol.
Where can I buy 3H-(1,2)Dithiolo(4,5,1-hi)(1,2)benzodithiole-8-s(iv), 2,6-diethyl-4,5-dihydro-?
You can request a quote for 3H-(1,2)Dithiolo(4,5,1-hi)(1,2)benzodithiole-8-s(iv), 2,6-diethyl-4,5-dihydro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3H-(1,2)Dithiolo(4,5,1-hi)(1,2)benzodithiole-8-s(iv), 2,6-diethyl-4,5-dihydro-?
Yes, KEHONG BIO provides custom synthesis services for 3H-(1,2)Dithiolo(4,5,1-hi)(1,2)benzodithiole-8-s(iv), 2,6-diethyl-4,5-dihydro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.