F0558-0115
TL;DR: F0558-0115 (CAS 681223-40-5) is a chemical compound with molecular formula C17H18IN3O2S2 and molecular weight 486.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-(4-iodophenyl)-1,3-thiazol-2-yl]-2-(2-oxo-2-pyrrolidin-1-ylethyl)sulfanylacetamide
Also Known As: F0558-0115, N-[4-(4-iodophenyl)-1,3-thiazol-2-yl]-2-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}acetamide, N-(4-(4-iodophenyl)thiazol-2-yl)-2-((2-oxo-2-(pyrrolidin-1-yl)ethyl)thio)acetamide, N-[4-(4-iodophenyl)-1,3-thiazol-2-yl]-2-(2-oxo-2-pyrrolidin-1-ylethyl)sulfanylacetamide, N-[4-(4-iodophenyl)-1,3-thiazol-2-yl]-2-(2-oxo-2-pyrrolidin-1-yl-ethyl)sulfanyl-acetamide
| Molecular Formula | C17H18IN3O2S2 |
|---|---|
| Molecular Weight | 486.99 g/mol |
| LogP | 3.7088 |
| Topological Polar Surface Area | 62.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 486.98853 |
| Heavy Atoms | 25 |
| Complexity | 742.60614 |
Chemical Identifiers
| CAS Number | 681223-40-5 |
|---|---|
| SMILES | C1CCN(C1)C(=O)CSCC(=O)NC2=NC(=CS2)C3=CC=C(C=C3)I |
Product Overview
F0558-0115 (CAS 681223-40-5), with molecular formula C17H18IN3O2S2 and molecular weight 486.99 g/mol. IUPAC: N-[4-(4-iodophenyl)-1,3-thiazol-2-yl]-2-(2-oxo-2-pyrrolidin-1-ylethyl)sulfanylacetamide.
Chemical Property Profile of F0558-0115
Property Insights of F0558-0115
The XLogP value of 3.7088 indicates that F0558-0115 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.3 Ų falls within the moderate polarity range, balancing permeability and solubility for F0558-0115. Following Lipinski's Rule of Five, F0558-0115 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 F0558-0115?
The CAS number of F0558-0115 is 681223-40-5.
What is the molecular formula of F0558-0115?
The molecular formula of F0558-0115 is C17H18IN3O2S2.
What is the molecular weight of F0558-0115?
The molecular weight of F0558-0115 is 486.99 g/mol.
Where can I buy F0558-0115?
You can request a quote for F0558-0115 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0558-0115?
Yes, KEHONG BIO provides custom synthesis services for F0558-0115 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.