F0558-0053
TL;DR: F0558-0053 (CAS 681222-68-4) is a chemical compound with molecular formula C22H29N3O2S2 and molecular weight 431.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-(3,4-dimethylphenyl)-1,3-thiazol-2-yl]-2-[2-(3,5-dimethylpiperidin-1-yl)-2-oxoethyl]sulfanylacetamide
Also Known As: F0558-0053, N-(4-(3,4-dimethylphenyl)thiazol-2-yl)-2-((2-(3,5-dimethylpiperidin-1-yl)-2-oxoethyl)thio)acetamide, N-[4-(3,4-dimethylphenyl)-1,3-thiazol-2-yl]-2-[2-(3,5-dimethylpiperidin-1-yl)-2-oxoethyl]sulfanylacetamide, N-[4-(3,4-dimethylphenyl)-1,3-thiazol-2-yl]-2-{[2-(3,5-dimethylpiperidin-1-yl)-2-oxoethyl]sulfanyl}acetamide
| Molecular Formula | C22H29N3O2S2 |
|---|---|
| Molecular Weight | 431.17 g/mol |
| LogP | 4.60314 |
| Topological Polar Surface Area | 62.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 431.1701 |
| Heavy Atoms | 29 |
| Complexity | 870.6924 |
Chemical Identifiers
| CAS Number | 681222-68-4 |
|---|---|
| SMILES | CC1CC(CN(C1)C(=O)CSCC(=O)NC2=NC(=CS2)C3=CC(=C(C=C3)C)C)C |
Product Overview
F0558-0053 (CAS 681222-68-4), with molecular formula C22H29N3O2S2 and molecular weight 431.17 g/mol. IUPAC: N-[4-(3,4-dimethylphenyl)-1,3-thiazol-2-yl]-2-[2-(3,5-dimethylpiperidin-1-yl)-2-oxoethyl]sulfanylacetamide.
Chemical Property Profile of F0558-0053
Property Insights of F0558-0053
The XLogP value of 4.60314 indicates that F0558-0053 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 F0558-0053. Following Lipinski's Rule of Five, F0558-0053 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 F0558-0053?
The CAS number of F0558-0053 is 681222-68-4.
What is the molecular formula of F0558-0053?
The molecular formula of F0558-0053 is C22H29N3O2S2.
What is the molecular weight of F0558-0053?
The molecular weight of F0558-0053 is 431.17 g/mol.
Where can I buy F0558-0053?
You can request a quote for F0558-0053 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0558-0053?
Yes, KEHONG BIO provides custom synthesis services for F0558-0053 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.