2-benzylsulfanyl-N-(2,6-difluorophenyl)propanamide
TL;DR: 2-benzylsulfanyl-N-(2,6-difluorophenyl)propanamide (CAS 701282-51-1) is a chemical compound with molecular formula C16H15F2NOS and molecular weight 307.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzylsulfanyl-N-(2,6-difluorophenyl)propanamide
Also Known As: 2-benzylsulfanyl-N-(2,6-difluorophenyl)propanamide, 2-(benzylsulfanyl)-N-(2,6-difluorophenyl)propanamide
| Molecular Formula | C16H15F2NOS |
|---|---|
| Molecular Weight | 307.08 g/mol |
| LogP | 4.2252 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 307.08423 |
| Heavy Atoms | 21 |
| Complexity | 598.67896 |
Chemical Identifiers
| CAS Number | 701282-51-1 |
|---|---|
| SMILES | CC(C(=O)NC1=C(C=CC=C1F)F)SCC2=CC=CC=C2 |
Product Overview
2-benzylsulfanyl-N-(2,6-difluorophenyl)propanamide (CAS 701282-51-1), with molecular formula C16H15F2NOS and molecular weight 307.08 g/mol. IUPAC: 2-benzylsulfanyl-N-(2,6-difluorophenyl)propanamide.
Chemical Property Profile of 2-benzylsulfanyl-N-(2,6-difluorophenyl)propanamide
Property Insights of 2-benzylsulfanyl-N-(2,6-difluorophenyl)propanamide
The XLogP value of 4.2252 indicates that 2-benzylsulfanyl-N-(2,6-difluorophenyl)propanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, 2-benzylsulfanyl-N-(2,6-difluorophenyl)propanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-benzylsulfanyl-N-(2,6-difluorophenyl)propanamide 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 2-benzylsulfanyl-N-(2,6-difluorophenyl)propanamide?
The CAS number of 2-benzylsulfanyl-N-(2,6-difluorophenyl)propanamide is 701282-51-1.
What is the molecular formula of 2-benzylsulfanyl-N-(2,6-difluorophenyl)propanamide?
The molecular formula of 2-benzylsulfanyl-N-(2,6-difluorophenyl)propanamide is C16H15F2NOS.
What is the molecular weight of 2-benzylsulfanyl-N-(2,6-difluorophenyl)propanamide?
The molecular weight of 2-benzylsulfanyl-N-(2,6-difluorophenyl)propanamide is 307.08 g/mol.
Where can I buy 2-benzylsulfanyl-N-(2,6-difluorophenyl)propanamide?
You can request a quote for 2-benzylsulfanyl-N-(2,6-difluorophenyl)propanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-benzylsulfanyl-N-(2,6-difluorophenyl)propanamide?
Yes, KEHONG BIO provides custom synthesis services for 2-benzylsulfanyl-N-(2,6-difluorophenyl)propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.