![1,3-Dithiole-2-thione, 4,5-bis[(phenylmethyl)thio]- structure](/static/products/5499/54995-25-4.webp)
1,3-Dithiole-2-thione, 4,5-bis[(phenylmethyl)thio]-
TL;DR: 1,3-Dithiole-2-thione, 4,5-bis[(phenylmethyl)thio]- (CAS 54995-25-4) is a chemical compound with molecular formula C17H14S5 and molecular weight 377.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,5-bis(benzylsulfanyl)-1,3-dithiole-2-thione
Also Known As: ChemDiv1_019447, 4,5-bis(benzylsulfanyl)-1,3-dithiole-2-thione, 1,3-Dithiole-2-thione, 4,5-bis[(phenylmethyl)thio]-, bis(benzoylthio)-1,3-dithiole-2-thione, 4,5-Bis(benzylthio)-1,3-dithiol-2-thione
| Molecular Formula | C17H14S5 |
|---|---|
| Molecular Weight | 377.97 g/mol |
| LogP | 7.12369 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 377.9699 |
| Heavy Atoms | 22 |
| Complexity | 694.50323 |
Chemical Identifiers
| CAS Number | 54995-25-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)CSC2=C(SC(=S)S2)SCC3=CC=CC=C3 |
Product Overview
1,3-Dithiole-2-thione, 4,5-bis[(phenylmethyl)thio]- (CAS 54995-25-4), with molecular formula C17H14S5 and molecular weight 377.97 g/mol. IUPAC: 4,5-bis(benzylsulfanyl)-1,3-dithiole-2-thione.
Chemical Property Profile of 1,3-Dithiole-2-thione, 4,5-bis[(phenylmethyl)thio]-
Property Insights of 1,3-Dithiole-2-thione, 4,5-bis[(phenylmethyl)thio]-
The XLogP value of 7.12369 indicates that 1,3-Dithiole-2-thione, 4,5-bis[(phenylmethyl)thio]- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1,3-Dithiole-2-thione, 4,5-bis[(phenylmethyl)thio]- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Dithiole-2-thione, 4,5-bis[(phenylmethyl)thio]- has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,3-Dithiole-2-thione, 4,5-bis[(phenylmethyl)thio]-?
The CAS number of 1,3-Dithiole-2-thione, 4,5-bis[(phenylmethyl)thio]- is 54995-25-4.
What is the molecular formula of 1,3-Dithiole-2-thione, 4,5-bis[(phenylmethyl)thio]-?
The molecular formula of 1,3-Dithiole-2-thione, 4,5-bis[(phenylmethyl)thio]- is C17H14S5.
What is the molecular weight of 1,3-Dithiole-2-thione, 4,5-bis[(phenylmethyl)thio]-?
The molecular weight of 1,3-Dithiole-2-thione, 4,5-bis[(phenylmethyl)thio]- is 377.97 g/mol.
Where can I buy 1,3-Dithiole-2-thione, 4,5-bis[(phenylmethyl)thio]-?
You can request a quote for 1,3-Dithiole-2-thione, 4,5-bis[(phenylmethyl)thio]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Dithiole-2-thione, 4,5-bis[(phenylmethyl)thio]-?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Dithiole-2-thione, 4,5-bis[(phenylmethyl)thio]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.