AB01325861-02
TL;DR: AB01325861-02 (CAS 620547-91-3) is a chemical compound with molecular formula C18H16O5S and molecular weight 344.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[(2Z)-2-[(3-methylthiophen-2-yl)methylidene]-3-oxo-1-benzofuran-6-yl]oxy]acetate
Also Known As: AB01325861-02, (Z)-ethyl 2-((2-((3-methylthiophen-2-yl)methylene)-3-oxo-2,3-dihydrobenzofuran-6-yl)oxy)acetate, F3385-0675, ethyl 2-[[(2Z)-2-[(3-methylthiophen-2-yl)methylidene]-3-oxo-1-benzofuran-6-yl]oxy]acetate, ethyl 2-{[(2Z)-2-[(3-methylthiophen-2-yl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl]oxy}acetate
| Molecular Formula | C18H16O5S |
|---|---|
| Molecular Weight | 344.07 g/mol |
| LogP | 3.61462 |
| Topological Polar Surface Area | 61.83 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 344.07184 |
| Heavy Atoms | 24 |
| Complexity | 818.56665 |
Chemical Identifiers
| CAS Number | 620547-91-3 |
|---|---|
| SMILES | CCOC(=O)COC1=CC2=C(C=C1)C(=O)/C(=C/C3=C(C=CS3)C)/O2 |
Product Overview
AB01325861-02 (CAS 620547-91-3), with molecular formula C18H16O5S and molecular weight 344.07 g/mol. IUPAC: ethyl 2-[[(2Z)-2-[(3-methylthiophen-2-yl)methylidene]-3-oxo-1-benzofuran-6-yl]oxy]acetate.
Chemical Property Profile of AB01325861-02
Property Insights of AB01325861-02
The XLogP value of 3.61462 indicates that AB01325861-02 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.83 Ų falls within the moderate polarity range, balancing permeability and solubility for AB01325861-02. Following Lipinski's Rule of Five, AB01325861-02 has 0 hydrogen bond donor(s) and 6 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 AB01325861-02?
The CAS number of AB01325861-02 is 620547-91-3.
What is the molecular formula of AB01325861-02?
The molecular formula of AB01325861-02 is C18H16O5S.
What is the molecular weight of AB01325861-02?
The molecular weight of AB01325861-02 is 344.07 g/mol.
Where can I buy AB01325861-02?
You can request a quote for AB01325861-02 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB01325861-02?
Yes, KEHONG BIO provides custom synthesis services for AB01325861-02 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.