3-((4-fluorophenyl)thio)-N-(2-methoxy-4-nitrophenyl)propanamide
TL;DR: 3-((4-fluorophenyl)thio)-N-(2-methoxy-4-nitrophenyl)propanamide (CAS 896357-75-8) is a chemical compound with molecular formula C16H15FN2O4S and molecular weight 350.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-fluorophenyl)sulfanyl-N-(2-methoxy-4-nitrophenyl)propanamide
Also Known As: F2537-1844, 3-[(4-fluorophenyl)sulfanyl]-N-(2-methoxy-4-nitrophenyl)propanamide, 3-((4-fluorophenyl)thio)-N-(2-methoxy-4-nitrophenyl)propanamide, 3-(4-fluorophenyl)sulfanyl-N-(2-methoxy-4-nitrophenyl)propanamide, N-(2-methoxy-4-nitrophenyl)3-(p-fluorophenylthio)propionamide
| Molecular Formula | C16H15FN2O4S |
|---|---|
| Molecular Weight | 350.07 g/mol |
| LogP | 3.8634 |
| Topological Polar Surface Area | 81.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 350.07367 |
| Heavy Atoms | 24 |
| Complexity | 737.3573 |
Chemical Identifiers
| CAS Number | 896357-75-8 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)CCSC2=CC=C(C=C2)F |
Product Overview
3-((4-fluorophenyl)thio)-N-(2-methoxy-4-nitrophenyl)propanamide (CAS 896357-75-8), with molecular formula C16H15FN2O4S and molecular weight 350.07 g/mol. IUPAC: 3-(4-fluorophenyl)sulfanyl-N-(2-methoxy-4-nitrophenyl)propanamide.
Chemical Property Profile of 3-((4-fluorophenyl)thio)-N-(2-methoxy-4-nitrophenyl)propanamide
Property Insights of 3-((4-fluorophenyl)thio)-N-(2-methoxy-4-nitrophenyl)propanamide
The XLogP value of 3.8634 indicates that 3-((4-fluorophenyl)thio)-N-(2-methoxy-4-nitrophenyl)propanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.47 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-((4-fluorophenyl)thio)-N-(2-methoxy-4-nitrophenyl)propanamide. Following Lipinski's Rule of Five, 3-((4-fluorophenyl)thio)-N-(2-methoxy-4-nitrophenyl)propanamide has 1 hydrogen bond donor(s) and 5 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-((4-fluorophenyl)thio)-N-(2-methoxy-4-nitrophenyl)propanamide?
The CAS number of 3-((4-fluorophenyl)thio)-N-(2-methoxy-4-nitrophenyl)propanamide is 896357-75-8.
What is the molecular formula of 3-((4-fluorophenyl)thio)-N-(2-methoxy-4-nitrophenyl)propanamide?
The molecular formula of 3-((4-fluorophenyl)thio)-N-(2-methoxy-4-nitrophenyl)propanamide is C16H15FN2O4S.
What is the molecular weight of 3-((4-fluorophenyl)thio)-N-(2-methoxy-4-nitrophenyl)propanamide?
The molecular weight of 3-((4-fluorophenyl)thio)-N-(2-methoxy-4-nitrophenyl)propanamide is 350.07 g/mol.
Where can I buy 3-((4-fluorophenyl)thio)-N-(2-methoxy-4-nitrophenyl)propanamide?
You can request a quote for 3-((4-fluorophenyl)thio)-N-(2-methoxy-4-nitrophenyl)propanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-((4-fluorophenyl)thio)-N-(2-methoxy-4-nitrophenyl)propanamide?
Yes, KEHONG BIO provides custom synthesis services for 3-((4-fluorophenyl)thio)-N-(2-methoxy-4-nitrophenyl)propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.