![2-[(4-fluorophenyl)methylsulfanyl]-N-(2-propan-2-yloxyphenyl)benzamide structure](/static/products/3392/339239-45-1.webp)
2-[(4-fluorophenyl)methylsulfanyl]-N-(2-propan-2-yloxyphenyl)benzamide
TL;DR: 2-[(4-fluorophenyl)methylsulfanyl]-N-(2-propan-2-yloxyphenyl)benzamide (CAS 339239-45-1) is a chemical compound with molecular formula C23H22FNO2S and molecular weight 395.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-fluorophenyl)methylsulfanyl]-N-(2-propan-2-yloxyphenyl)benzamide
Also Known As: BIM-0042761.P001, A0545/0025178, 2-(4-Fluoro-benzylsulfanyl)-N-(2-isopropoxy-phenyl)-benzamide, 2-[(4-fluorophenyl)methylsulfanyl]-N-(2-propan-2-yloxyphenyl)benzamide, 2-[(4-fluorobenzyl)sulfanyl]-N-[2-(propan-2-yloxy)phenyl]benzamide
| Molecular Formula | C23H22FNO2S |
|---|---|
| Molecular Weight | 395.14 g/mol |
| LogP | 5.6 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 395.13553 |
| Heavy Atoms | 28 |
| Complexity | 481.0 |
Chemical Identifiers
| CAS Number | 339239-45-1 |
|---|---|
| SMILES | CC(C)OC1=CC=CC=C1NC(=O)C2=CC=CC=C2SCC3=CC=C(C=C3)F |
| InChIKey | JCAVNGVDZJMTRB-UHFFFAOYSA-N |
Product Overview
2-[(4-fluorophenyl)methylsulfanyl]-N-(2-propan-2-yloxyphenyl)benzamide (CAS 339239-45-1), with molecular formula C23H22FNO2S and molecular weight 395.14 g/mol. IUPAC: 2-[(4-fluorophenyl)methylsulfanyl]-N-(2-propan-2-yloxyphenyl)benzamide.
Chemical Property Profile of 2-[(4-fluorophenyl)methylsulfanyl]-N-(2-propan-2-yloxyphenyl)benzamide
Property Insights of 2-[(4-fluorophenyl)methylsulfanyl]-N-(2-propan-2-yloxyphenyl)benzamide
The XLogP value of 5.6 indicates that 2-[(4-fluorophenyl)methylsulfanyl]-N-(2-propan-2-yloxyphenyl)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(4-fluorophenyl)methylsulfanyl]-N-(2-propan-2-yloxyphenyl)benzamide. Following Lipinski's Rule of Five, 2-[(4-fluorophenyl)methylsulfanyl]-N-(2-propan-2-yloxyphenyl)benzamide has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-[(4-fluorophenyl)methylsulfanyl]-N-(2-propan-2-yloxyphenyl)benzamide?
The CAS number of 2-[(4-fluorophenyl)methylsulfanyl]-N-(2-propan-2-yloxyphenyl)benzamide is 339239-45-1.
What is the molecular formula of 2-[(4-fluorophenyl)methylsulfanyl]-N-(2-propan-2-yloxyphenyl)benzamide?
The molecular formula of 2-[(4-fluorophenyl)methylsulfanyl]-N-(2-propan-2-yloxyphenyl)benzamide is C23H22FNO2S.
What is the molecular weight of 2-[(4-fluorophenyl)methylsulfanyl]-N-(2-propan-2-yloxyphenyl)benzamide?
The molecular weight of 2-[(4-fluorophenyl)methylsulfanyl]-N-(2-propan-2-yloxyphenyl)benzamide is 395.14 g/mol.
Where can I buy 2-[(4-fluorophenyl)methylsulfanyl]-N-(2-propan-2-yloxyphenyl)benzamide?
You can request a quote for 2-[(4-fluorophenyl)methylsulfanyl]-N-(2-propan-2-yloxyphenyl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(4-fluorophenyl)methylsulfanyl]-N-(2-propan-2-yloxyphenyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 2-[(4-fluorophenyl)methylsulfanyl]-N-(2-propan-2-yloxyphenyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.