![3-[Bis(phenylsulfanyl)methyl]cyclopentan-1-one structure](/static/products/6981/69814-22-8.webp)
3-[Bis(phenylsulfanyl)methyl]cyclopentan-1-one
TL;DR: 3-[Bis(phenylsulfanyl)methyl]cyclopentan-1-one (CAS 69814-22-8) is a chemical compound with molecular formula C18H18OS2 and molecular weight 314.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[bis(phenylsulfanyl)methyl]cyclopentan-1-one
Also Known As: 3-[bis(phenylsulfanyl)methyl]cyclopentan-1-one, CYCLOPENTANONE,3-[BIS(PHENYLTHIO)METHYL]-
| Molecular Formula | C18H18OS2 |
|---|---|
| Molecular Weight | 314.08 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 67.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 314.0799 |
| Heavy Atoms | 21 |
| Complexity | 312.0 |
Chemical Identifiers
| CAS Number | 69814-22-8 |
|---|---|
| SMILES | C1CC(=O)CC1C(SC2=CC=CC=C2)SC3=CC=CC=C3 |
| InChIKey | WIXFAISMALCULJ-UHFFFAOYSA-N |
Product Overview
3-[Bis(phenylsulfanyl)methyl]cyclopentan-1-one (CAS 69814-22-8), with molecular formula C18H18OS2 and molecular weight 314.08 g/mol. IUPAC: 3-[bis(phenylsulfanyl)methyl]cyclopentan-1-one.
Chemical Property Profile of 3-[Bis(phenylsulfanyl)methyl]cyclopentan-1-one
Property Insights of 3-[Bis(phenylsulfanyl)methyl]cyclopentan-1-one
The XLogP value of 4.9 indicates that 3-[Bis(phenylsulfanyl)methyl]cyclopentan-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[Bis(phenylsulfanyl)methyl]cyclopentan-1-one. Following Lipinski's Rule of Five, 3-[Bis(phenylsulfanyl)methyl]cyclopentan-1-one 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 3-[Bis(phenylsulfanyl)methyl]cyclopentan-1-one?
The CAS number of 3-[Bis(phenylsulfanyl)methyl]cyclopentan-1-one is 69814-22-8.
What is the molecular formula of 3-[Bis(phenylsulfanyl)methyl]cyclopentan-1-one?
The molecular formula of 3-[Bis(phenylsulfanyl)methyl]cyclopentan-1-one is C18H18OS2.
What is the molecular weight of 3-[Bis(phenylsulfanyl)methyl]cyclopentan-1-one?
The molecular weight of 3-[Bis(phenylsulfanyl)methyl]cyclopentan-1-one is 314.08 g/mol.
Where can I buy 3-[Bis(phenylsulfanyl)methyl]cyclopentan-1-one?
You can request a quote for 3-[Bis(phenylsulfanyl)methyl]cyclopentan-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[Bis(phenylsulfanyl)methyl]cyclopentan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 3-[Bis(phenylsulfanyl)methyl]cyclopentan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.