(1,2)Dithiolo(1,5-b)(1,2)dithiole-7-s(iv), 3,4-dimethyl-
TL;DR: (1,2)Dithiolo(1,5-b)(1,2)dithiole-7-s(iv), 3,4-dimethyl- (CAS 29977-00-2) is a chemical compound with molecular formula C7H8S3 and molecular weight 187.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,6-dimethyl-1λ4,2,8-trithiabicyclo[3.3.0]octa-1(5),3,6-triene
Also Known As: 4,6-dimethyl-1, (1,2)Dithiolo(1,5-b)(1,2)dithiole-7-s(iv), 3,4-dimethyl-, [1,2]Dithiolo[1,5-b][1,2]dithiole-7-S(IV),3,4-dimethyl-, 3,4-Dimethyl-7lambda~4~-[1,2]dithiolo[1,5-b][1,2]dithiole, RefChem:204105
| Molecular Formula | C7H8S3 |
|---|---|
| Molecular Weight | 187.98 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 69.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 187.97882 |
| Heavy Atoms | 10 |
| Complexity | 245.0 |
Chemical Identifiers
| CAS Number | 29977-00-2 |
|---|---|
| SMILES | CC1=CSS2=C1C(=CS2)C |
| InChIKey | VTGFQKXULVUPDJ-UHFFFAOYSA-N |
Product Overview
(1,2)Dithiolo(1,5-b)(1,2)dithiole-7-s(iv), 3,4-dimethyl- (CAS 29977-00-2), with molecular formula C7H8S3 and molecular weight 187.98 g/mol. IUPAC: 4,6-dimethyl-1λ4,2,8-trithiabicyclo[3.3.0]octa-1(5),3,6-triene.
Chemical Property Profile of (1,2)Dithiolo(1,5-b)(1,2)dithiole-7-s(iv), 3,4-dimethyl-
Property Insights of (1,2)Dithiolo(1,5-b)(1,2)dithiole-7-s(iv), 3,4-dimethyl-
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1,2)Dithiolo(1,5-b)(1,2)dithiole-7-s(iv), 3,4-dimethyl-. The TPSA of 69.8 Ų falls within the moderate polarity range, balancing permeability and solubility for (1,2)Dithiolo(1,5-b)(1,2)dithiole-7-s(iv), 3,4-dimethyl-. Following Lipinski's Rule of Five, (1,2)Dithiolo(1,5-b)(1,2)dithiole-7-s(iv), 3,4-dimethyl- 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 (1,2)Dithiolo(1,5-b)(1,2)dithiole-7-s(iv), 3,4-dimethyl-?
The CAS number of (1,2)Dithiolo(1,5-b)(1,2)dithiole-7-s(iv), 3,4-dimethyl- is 29977-00-2.
What is the molecular formula of (1,2)Dithiolo(1,5-b)(1,2)dithiole-7-s(iv), 3,4-dimethyl-?
The molecular formula of (1,2)Dithiolo(1,5-b)(1,2)dithiole-7-s(iv), 3,4-dimethyl- is C7H8S3.
What is the molecular weight of (1,2)Dithiolo(1,5-b)(1,2)dithiole-7-s(iv), 3,4-dimethyl-?
The molecular weight of (1,2)Dithiolo(1,5-b)(1,2)dithiole-7-s(iv), 3,4-dimethyl- is 187.98 g/mol.
Where can I buy (1,2)Dithiolo(1,5-b)(1,2)dithiole-7-s(iv), 3,4-dimethyl-?
You can request a quote for (1,2)Dithiolo(1,5-b)(1,2)dithiole-7-s(iv), 3,4-dimethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1,2)Dithiolo(1,5-b)(1,2)dithiole-7-s(iv), 3,4-dimethyl-?
Yes, KEHONG BIO provides custom synthesis services for (1,2)Dithiolo(1,5-b)(1,2)dithiole-7-s(iv), 3,4-dimethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.