4'-(Methylthio)-3-phenylpropionanilide
TL;DR: 4'-(Methylthio)-3-phenylpropionanilide (CAS 27816-91-7) is a chemical compound with molecular formula C16H17NOS and molecular weight 271.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-methylsulfanylphenyl)-3-phenylpropanamide
Also Known As: N-(4-methylsulfanylphenyl)-3-phenylpropanamide, 4'-(METHYLTHIO)-3-PHENYLPROPIONANILIDE, N-[4-(methylsulfanyl)phenyl]-3-phenylpropanamide, N-(4-(Methylthio)phenyl)-3-phenylpropanamide, 662-540-9
| Molecular Formula | C16H17NOS |
|---|---|
| Molecular Weight | 271.10 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 271.1031 |
| Heavy Atoms | 19 |
| Complexity | 268.0 |
Chemical Identifiers
| CAS Number | 27816-91-7 |
|---|---|
| SMILES | CSC1=CC=C(C=C1)NC(=O)CCC2=CC=CC=C2 |
| InChIKey | GXFRSFKKPVYNKV-UHFFFAOYSA-N |
Product Overview
4'-(Methylthio)-3-phenylpropionanilide (CAS 27816-91-7), with molecular formula C16H17NOS and molecular weight 271.10 g/mol. IUPAC: N-(4-methylsulfanylphenyl)-3-phenylpropanamide.
Chemical Property Profile of 4'-(Methylthio)-3-phenylpropionanilide
Property Insights of 4'-(Methylthio)-3-phenylpropionanilide
The XLogP value of 3.5 indicates that 4'-(Methylthio)-3-phenylpropionanilide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.4 Ų, 4'-(Methylthio)-3-phenylpropionanilide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4'-(Methylthio)-3-phenylpropionanilide has 1 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 4'-(Methylthio)-3-phenylpropionanilide?
The CAS number of 4'-(Methylthio)-3-phenylpropionanilide is 27816-91-7.
What is the molecular formula of 4'-(Methylthio)-3-phenylpropionanilide?
The molecular formula of 4'-(Methylthio)-3-phenylpropionanilide is C16H17NOS.
What is the molecular weight of 4'-(Methylthio)-3-phenylpropionanilide?
The molecular weight of 4'-(Methylthio)-3-phenylpropionanilide is 271.10 g/mol.
Where can I buy 4'-(Methylthio)-3-phenylpropionanilide?
You can request a quote for 4'-(Methylthio)-3-phenylpropionanilide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4'-(Methylthio)-3-phenylpropionanilide?
Yes, KEHONG BIO provides custom synthesis services for 4'-(Methylthio)-3-phenylpropionanilide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.