ChemDiv1_010555
TL;DR: ChemDiv1_010555 (CAS 442563-94-2) is a chemical compound with molecular formula C23H23ClO7 and molecular weight 446.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethoxyethyl 2-[3-(4-chloro-3,5-dimethylphenoxy)-4-oxochromen-7-yl]oxyacetate
Also Known As: ChemDiv1_010555, AB00147823-02, 2-ethoxyethyl {[3-(4-chloro-3,5-dimethylphenoxy)-4-oxo-4H-chromen-7-yl]oxy}acetate, 2-ethoxyethyl 2-((3-(4-chloro-3,5-dimethylphenoxy)-4-oxo-4H-chromen-7-yl)oxy)acetate, 2-ethoxyethyl 2-[3-(4-chloro-3,5-dimethylphenoxy)-4-oxochromen-7-yl]oxyacetate
| Molecular Formula | C23H23ClO7 |
|---|---|
| Molecular Weight | 446.11 g/mol |
| LogP | 4.81404 |
| Topological Polar Surface Area | 84.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 446.11322 |
| Heavy Atoms | 31 |
| Complexity | 1113.4585 |
Chemical Identifiers
| CAS Number | 442563-94-2 |
|---|---|
| SMILES | CCOCCOC(=O)COC1=CC2=C(C=C1)C(=O)C(=CO2)OC3=CC(=C(C(=C3)C)Cl)C |
Product Overview
ChemDiv1_010555 (CAS 442563-94-2), with molecular formula C23H23ClO7 and molecular weight 446.11 g/mol. IUPAC: 2-ethoxyethyl 2-[3-(4-chloro-3,5-dimethylphenoxy)-4-oxochromen-7-yl]oxyacetate.
Chemical Property Profile of ChemDiv1_010555
Property Insights of ChemDiv1_010555
The XLogP value of 4.81404 indicates that ChemDiv1_010555 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.2 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_010555. Following Lipinski's Rule of Five, ChemDiv1_010555 has 0 hydrogen bond donor(s) and 7 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 ChemDiv1_010555?
The CAS number of ChemDiv1_010555 is 442563-94-2.
What is the molecular formula of ChemDiv1_010555?
The molecular formula of ChemDiv1_010555 is C23H23ClO7.
What is the molecular weight of ChemDiv1_010555?
The molecular weight of ChemDiv1_010555 is 446.11 g/mol.
Where can I buy ChemDiv1_010555?
You can request a quote for ChemDiv1_010555 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_010555?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_010555 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.