Bis(5-thiocyanatothiophen-2-yl)sulfane
TL;DR: Bis(5-thiocyanatothiophen-2-yl)sulfane (CAS 30835-99-5) is a chemical compound with molecular formula C10H4N2S5 and molecular weight 311.90 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[5-(5-thiocyanatothiophen-2-yl)sulfanylthiophen-2-yl] thiocyanate
Also Known As: 2-thiocyanato-5-thienyl mercaptide, bis(5-thiocyanatothiophen-2-yl)sulfane, 2-thiocyanato-5-(5-thiocyanatothiophen-2-yl)sulfanyl-thiophene, [5-(5-thiocyanatothiophen-2-yl)sulfanylthiophen-2-yl] thiocyanate
| Molecular Formula | C10H4N2S5 |
|---|---|
| Molecular Weight | 311.90 g/mol |
| LogP | 5.10716 |
| Topological Polar Surface Area | 47.58 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 311.8978 |
| Heavy Atoms | 17 |
| Complexity | 534.0985 |
Chemical Identifiers
| CAS Number | 30835-99-5 |
|---|---|
| SMILES | C1=C(SC(=C1)SC2=CC=C(S2)SC#N)SC#N |
Product Overview
Bis(5-thiocyanatothiophen-2-yl)sulfane (CAS 30835-99-5), with molecular formula C10H4N2S5 and molecular weight 311.90 g/mol. IUPAC: [5-(5-thiocyanatothiophen-2-yl)sulfanylthiophen-2-yl] thiocyanate.
Chemical Property Profile of Bis(5-thiocyanatothiophen-2-yl)sulfane
Property Insights of Bis(5-thiocyanatothiophen-2-yl)sulfane
The XLogP value of 5.10716 indicates that Bis(5-thiocyanatothiophen-2-yl)sulfane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.58 Ų, Bis(5-thiocyanatothiophen-2-yl)sulfane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bis(5-thiocyanatothiophen-2-yl)sulfane has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Bis(5-thiocyanatothiophen-2-yl)sulfane?
The CAS number of Bis(5-thiocyanatothiophen-2-yl)sulfane is 30835-99-5.
What is the molecular formula of Bis(5-thiocyanatothiophen-2-yl)sulfane?
The molecular formula of Bis(5-thiocyanatothiophen-2-yl)sulfane is C10H4N2S5.
What is the molecular weight of Bis(5-thiocyanatothiophen-2-yl)sulfane?
The molecular weight of Bis(5-thiocyanatothiophen-2-yl)sulfane is 311.90 g/mol.
Where can I buy Bis(5-thiocyanatothiophen-2-yl)sulfane?
You can request a quote for Bis(5-thiocyanatothiophen-2-yl)sulfane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bis(5-thiocyanatothiophen-2-yl)sulfane?
Yes, KEHONG BIO provides custom synthesis services for Bis(5-thiocyanatothiophen-2-yl)sulfane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.