((2-(Phenylthio)-1-cyclobuten-1-yl)thio)benzene
TL;DR: ((2-(Phenylthio)-1-cyclobuten-1-yl)thio)benzene (CAS 70871-28-2) is a chemical compound with molecular formula C16H14S2 and molecular weight 270.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-phenylsulfanylcyclobuten-1-yl)sulfanylbenzene
Also Known As: ((2-(Phenylthio)-1-cyclobuten-1-yl)thio)benzene, 1,2-Bis(phenylthio)cyclobut-1-ene, (2-phenylsulfanylcyclobuten-1-yl)sulfanylbenzene, [[2-(phenylthio)-1-cyclobutenyl]thio]benzene, BENZENE, 1,1'-(1-CYCLOBUTENE-1,2-DIYLBIS(THIO))BIS-
| Molecular Formula | C16H14S2 |
|---|---|
| Molecular Weight | 270.05 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 50.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 270.05368 |
| Heavy Atoms | 18 |
| Complexity | 266.0 |
Chemical Identifiers
| CAS Number | 70871-28-2 |
|---|---|
| SMILES | C1CC(=C1SC2=CC=CC=C2)SC3=CC=CC=C3 |
| InChIKey | UJZBTGXCKCXUDW-UHFFFAOYSA-N |
Product Overview
((2-(Phenylthio)-1-cyclobuten-1-yl)thio)benzene (CAS 70871-28-2), with molecular formula C16H14S2 and molecular weight 270.05 g/mol. IUPAC: (2-phenylsulfanylcyclobuten-1-yl)sulfanylbenzene.
Chemical Property Profile of ((2-(Phenylthio)-1-cyclobuten-1-yl)thio)benzene
Property Insights of ((2-(Phenylthio)-1-cyclobuten-1-yl)thio)benzene
The XLogP value of 5.0 indicates that ((2-(Phenylthio)-1-cyclobuten-1-yl)thio)benzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.6 Ų, ((2-(Phenylthio)-1-cyclobuten-1-yl)thio)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ((2-(Phenylthio)-1-cyclobuten-1-yl)thio)benzene has 0 hydrogen bond donor(s) and 2 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 ((2-(Phenylthio)-1-cyclobuten-1-yl)thio)benzene?
The CAS number of ((2-(Phenylthio)-1-cyclobuten-1-yl)thio)benzene is 70871-28-2.
What is the molecular formula of ((2-(Phenylthio)-1-cyclobuten-1-yl)thio)benzene?
The molecular formula of ((2-(Phenylthio)-1-cyclobuten-1-yl)thio)benzene is C16H14S2.
What is the molecular weight of ((2-(Phenylthio)-1-cyclobuten-1-yl)thio)benzene?
The molecular weight of ((2-(Phenylthio)-1-cyclobuten-1-yl)thio)benzene is 270.05 g/mol.
Where can I buy ((2-(Phenylthio)-1-cyclobuten-1-yl)thio)benzene?
You can request a quote for ((2-(Phenylthio)-1-cyclobuten-1-yl)thio)benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ((2-(Phenylthio)-1-cyclobuten-1-yl)thio)benzene?
Yes, KEHONG BIO provides custom synthesis services for ((2-(Phenylthio)-1-cyclobuten-1-yl)thio)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.