Benzene, 1-methoxy-4-(1-(phenylthio)propyl)-
TL;DR: Benzene, 1-methoxy-4-(1-(phenylthio)propyl)- (CAS 60702-14-9) is a chemical compound with molecular formula C16H18OS and molecular weight 258.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methoxy-4-(1-phenylsulfanylpropyl)benzene
Also Known As: 1-(4-Methoxyphenyl)-1-phenylthiopropane, Anisole, p-(1-(phenylthio)propyl)-, 1-Methoxy-4-[1- propyl]benzene, Propane, 1-(4-methoxyphenyl)-1-phenylthio-, Benzene, 1-methoxy-4-(1-(phenylthio)propyl)-
| Molecular Formula | C16H18OS |
|---|---|
| Molecular Weight | 258.11 g/mol |
| LogP | 4.9386 |
| Topological Polar Surface Area | 9.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 258.10785 |
| Heavy Atoms | 18 |
| Complexity | 464.21545 |
Chemical Identifiers
| CAS Number | 60702-14-9 |
|---|---|
| SMILES | CCC(C1=CC=C(C=C1)OC)SC2=CC=CC=C2 |
Product Overview
Benzene, 1-methoxy-4-(1-(phenylthio)propyl)- (CAS 60702-14-9), with molecular formula C16H18OS and molecular weight 258.11 g/mol. IUPAC: 1-methoxy-4-(1-phenylsulfanylpropyl)benzene.
Chemical Property Profile of Benzene, 1-methoxy-4-(1-(phenylthio)propyl)-
Property Insights of Benzene, 1-methoxy-4-(1-(phenylthio)propyl)-
The XLogP value of 4.9386 indicates that Benzene, 1-methoxy-4-(1-(phenylthio)propyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.23 Ų, Benzene, 1-methoxy-4-(1-(phenylthio)propyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzene, 1-methoxy-4-(1-(phenylthio)propyl)- 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 Benzene, 1-methoxy-4-(1-(phenylthio)propyl)-?
The CAS number of Benzene, 1-methoxy-4-(1-(phenylthio)propyl)- is 60702-14-9.
What is the molecular formula of Benzene, 1-methoxy-4-(1-(phenylthio)propyl)-?
The molecular formula of Benzene, 1-methoxy-4-(1-(phenylthio)propyl)- is C16H18OS.
What is the molecular weight of Benzene, 1-methoxy-4-(1-(phenylthio)propyl)-?
The molecular weight of Benzene, 1-methoxy-4-(1-(phenylthio)propyl)- is 258.11 g/mol.
Where can I buy Benzene, 1-methoxy-4-(1-(phenylthio)propyl)-?
You can request a quote for Benzene, 1-methoxy-4-(1-(phenylthio)propyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzene, 1-methoxy-4-(1-(phenylthio)propyl)-?
Yes, KEHONG BIO provides custom synthesis services for Benzene, 1-methoxy-4-(1-(phenylthio)propyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.