1-Pentanone, 1-phenyl-2-(phenylthio)-
TL;DR: 1-Pentanone, 1-phenyl-2-(phenylthio)- (CAS 59919-12-9) is a chemical compound with molecular formula C17H18OS and molecular weight 270.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-phenyl-2-phenylsulfanylpentan-1-one
Also Known As: alpha-(Phenylthio)valerophenone, 1-Pentanone, 1-phenyl-2-(phenylthio)-, 1-phenyl-2-phenylsulfanylpentan-1-one, 1-Phenyl-2-phenylthiopentan-1-one, 1-Phenyl-2-(phenylthio)-1-pentanone
| Molecular Formula | C17H18OS |
|---|---|
| Molecular Weight | 270.11 g/mol |
| LogP | 4.8303 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 270.10785 |
| Heavy Atoms | 19 |
| Complexity | 507.3 |
Chemical Identifiers
| CAS Number | 59919-12-9 |
|---|---|
| SMILES | CCCC(C(=O)C1=CC=CC=C1)SC2=CC=CC=C2 |
Product Overview
1-Pentanone, 1-phenyl-2-(phenylthio)- (CAS 59919-12-9), with molecular formula C17H18OS and molecular weight 270.11 g/mol. IUPAC: 1-phenyl-2-phenylsulfanylpentan-1-one.
Chemical Property Profile of 1-Pentanone, 1-phenyl-2-(phenylthio)-
Property Insights of 1-Pentanone, 1-phenyl-2-(phenylthio)-
The XLogP value of 4.8303 indicates that 1-Pentanone, 1-phenyl-2-(phenylthio)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.07 Ų, 1-Pentanone, 1-phenyl-2-(phenylthio)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Pentanone, 1-phenyl-2-(phenylthio)- 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 1-Pentanone, 1-phenyl-2-(phenylthio)-?
The CAS number of 1-Pentanone, 1-phenyl-2-(phenylthio)- is 59919-12-9.
What is the molecular formula of 1-Pentanone, 1-phenyl-2-(phenylthio)-?
The molecular formula of 1-Pentanone, 1-phenyl-2-(phenylthio)- is C17H18OS.
What is the molecular weight of 1-Pentanone, 1-phenyl-2-(phenylthio)-?
The molecular weight of 1-Pentanone, 1-phenyl-2-(phenylthio)- is 270.11 g/mol.
Where can I buy 1-Pentanone, 1-phenyl-2-(phenylthio)-?
You can request a quote for 1-Pentanone, 1-phenyl-2-(phenylthio)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Pentanone, 1-phenyl-2-(phenylthio)-?
Yes, KEHONG BIO provides custom synthesis services for 1-Pentanone, 1-phenyl-2-(phenylthio)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.