3-(3-((4-Fluorophenyl)thio)propanamido)benzofuran-2-carboxamide
TL;DR: 3-(3-((4-Fluorophenyl)thio)propanamido)benzofuran-2-carboxamide (CAS 896355-08-1) is a chemical compound with molecular formula C18H15FN2O3S and molecular weight 358.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[3-(4-fluorophenyl)sulfanylpropanoylamino]-1-benzofuran-2-carboxamide
Also Known As: 3-{3-[(4-fluorophenyl)sulfanyl]propanamido}-1-benzofuran-2-carboxamide, 3-(3-((4-fluorophenyl)thio)propanamido)benzofuran-2-carboxamide, F2537-1760, 3-[3-(4-fluorophenyl)sulfanylpropanoylamino]-1-benzofuran-2-carboxamide
| Molecular Formula | C18H15FN2O3S |
|---|---|
| Molecular Weight | 358.08 g/mol |
| LogP | 3.7917 |
| Topological Polar Surface Area | 85.33 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 358.07874 |
| Heavy Atoms | 25 |
| Complexity | 921.7208 |
Chemical Identifiers
| CAS Number | 896355-08-1 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=C(O2)C(=O)N)NC(=O)CCSC3=CC=C(C=C3)F |
Product Overview
3-(3-((4-Fluorophenyl)thio)propanamido)benzofuran-2-carboxamide (CAS 896355-08-1), with molecular formula C18H15FN2O3S and molecular weight 358.08 g/mol. IUPAC: 3-[3-(4-fluorophenyl)sulfanylpropanoylamino]-1-benzofuran-2-carboxamide.
Chemical Property Profile of 3-(3-((4-Fluorophenyl)thio)propanamido)benzofuran-2-carboxamide
Property Insights of 3-(3-((4-Fluorophenyl)thio)propanamido)benzofuran-2-carboxamide
The XLogP value of 3.7917 indicates that 3-(3-((4-Fluorophenyl)thio)propanamido)benzofuran-2-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.33 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(3-((4-Fluorophenyl)thio)propanamido)benzofuran-2-carboxamide. Following Lipinski's Rule of Five, 3-(3-((4-Fluorophenyl)thio)propanamido)benzofuran-2-carboxamide has 2 hydrogen bond donor(s) and 4 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-(3-((4-Fluorophenyl)thio)propanamido)benzofuran-2-carboxamide?
The CAS number of 3-(3-((4-Fluorophenyl)thio)propanamido)benzofuran-2-carboxamide is 896355-08-1.
What is the molecular formula of 3-(3-((4-Fluorophenyl)thio)propanamido)benzofuran-2-carboxamide?
The molecular formula of 3-(3-((4-Fluorophenyl)thio)propanamido)benzofuran-2-carboxamide is C18H15FN2O3S.
What is the molecular weight of 3-(3-((4-Fluorophenyl)thio)propanamido)benzofuran-2-carboxamide?
The molecular weight of 3-(3-((4-Fluorophenyl)thio)propanamido)benzofuran-2-carboxamide is 358.08 g/mol.
Where can I buy 3-(3-((4-Fluorophenyl)thio)propanamido)benzofuran-2-carboxamide?
You can request a quote for 3-(3-((4-Fluorophenyl)thio)propanamido)benzofuran-2-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(3-((4-Fluorophenyl)thio)propanamido)benzofuran-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 3-(3-((4-Fluorophenyl)thio)propanamido)benzofuran-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.