(3-(Methylthio)phenyl)(4-phenylpiperazin-1-yl)methanone
TL;DR: (3-(Methylthio)phenyl)(4-phenylpiperazin-1-yl)methanone (CAS 896343-48-9) is a chemical compound with molecular formula C18H20N2OS and molecular weight 312.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-methylsulfanylphenyl)-(4-phenylpiperazin-1-yl)methanone
Also Known As: 1-[3-(methylsulfanyl)benzoyl]-4-phenylpiperazine, (3-(methylthio)phenyl)(4-phenylpiperazin-1-yl)methanone, (3-methylsulfanylphenyl)-(4-phenylpiperazin-1-yl)methanone, F2554-0225
| Molecular Formula | C18H20N2OS |
|---|---|
| Molecular Weight | 312.13 g/mol |
| LogP | 3.3709 |
| Topological Polar Surface Area | 23.55 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 312.12964 |
| Heavy Atoms | 22 |
| Complexity | 636.5452 |
Chemical Identifiers
| CAS Number | 896343-48-9 |
|---|---|
| SMILES | CSC1=CC=CC(=C1)C(=O)N2CCN(CC2)C3=CC=CC=C3 |
Product Overview
(3-(Methylthio)phenyl)(4-phenylpiperazin-1-yl)methanone (CAS 896343-48-9), with molecular formula C18H20N2OS and molecular weight 312.13 g/mol. IUPAC: (3-methylsulfanylphenyl)-(4-phenylpiperazin-1-yl)methanone.
Chemical Property Profile of (3-(Methylthio)phenyl)(4-phenylpiperazin-1-yl)methanone
Property Insights of (3-(Methylthio)phenyl)(4-phenylpiperazin-1-yl)methanone
The XLogP value of 3.3709 indicates that (3-(Methylthio)phenyl)(4-phenylpiperazin-1-yl)methanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.55 Ų, (3-(Methylthio)phenyl)(4-phenylpiperazin-1-yl)methanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3-(Methylthio)phenyl)(4-phenylpiperazin-1-yl)methanone 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-(Methylthio)phenyl)(4-phenylpiperazin-1-yl)methanone?
The CAS number of (3-(Methylthio)phenyl)(4-phenylpiperazin-1-yl)methanone is 896343-48-9.
What is the molecular formula of (3-(Methylthio)phenyl)(4-phenylpiperazin-1-yl)methanone?
The molecular formula of (3-(Methylthio)phenyl)(4-phenylpiperazin-1-yl)methanone is C18H20N2OS.
What is the molecular weight of (3-(Methylthio)phenyl)(4-phenylpiperazin-1-yl)methanone?
The molecular weight of (3-(Methylthio)phenyl)(4-phenylpiperazin-1-yl)methanone is 312.13 g/mol.
Where can I buy (3-(Methylthio)phenyl)(4-phenylpiperazin-1-yl)methanone?
You can request a quote for (3-(Methylthio)phenyl)(4-phenylpiperazin-1-yl)methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3-(Methylthio)phenyl)(4-phenylpiperazin-1-yl)methanone?
Yes, KEHONG BIO provides custom synthesis services for (3-(Methylthio)phenyl)(4-phenylpiperazin-1-yl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.