F1110-0053
TL;DR: F1110-0053 (CAS 683250-45-5) is a chemical compound with molecular formula C22H17ClN2O4S and molecular weight 440.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[(E)-2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-2-cyanoethenyl]-2,6-dimethoxyphenyl] acetate
Also Known As: F1110-0053, 4-[(1E)-2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-2-cyanoeth-1-en-1-yl]-2,6-dimethoxyphenyl acetate, (E)-4-(2-(4-(4-chlorophenyl)thiazol-2-yl)-2-cyanovinyl)-2,6-dimethoxyphenyl acetate, [4-[(E)-2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-2-cyanoethenyl]-2,6-dimethoxyphenyl] acetate, [4-[2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-2-cyano-ethenyl]-2,6-dimethoxy-phenyl] Acetate
| Molecular Formula | C22H17ClN2O4S |
|---|---|
| Molecular Weight | 440.06 g/mol |
| LogP | 5.47018 |
| Topological Polar Surface Area | 81.44 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 440.05975 |
| Heavy Atoms | 30 |
| Complexity | 1121.6844 |
Chemical Identifiers
| CAS Number | 683250-45-5 |
|---|---|
| SMILES | CC(=O)OC1=C(C=C(C=C1OC)/C=C(\C#N)/C2=NC(=CS2)C3=CC=C(C=C3)Cl)OC |
Product Overview
F1110-0053 (CAS 683250-45-5), with molecular formula C22H17ClN2O4S and molecular weight 440.06 g/mol. IUPAC: [4-[(E)-2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-2-cyanoethenyl]-2,6-dimethoxyphenyl] acetate.
Chemical Property Profile of F1110-0053
Property Insights of F1110-0053
The XLogP value of 5.47018 indicates that F1110-0053 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.44 Ų falls within the moderate polarity range, balancing permeability and solubility for F1110-0053. Following Lipinski's Rule of Five, F1110-0053 has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F1110-0053?
The CAS number of F1110-0053 is 683250-45-5.
What is the molecular formula of F1110-0053?
The molecular formula of F1110-0053 is C22H17ClN2O4S.
What is the molecular weight of F1110-0053?
The molecular weight of F1110-0053 is 440.06 g/mol.
Where can I buy F1110-0053?
You can request a quote for F1110-0053 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1110-0053?
Yes, KEHONG BIO provides custom synthesis services for F1110-0053 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.