AB00397874-04
TL;DR: AB00397874-04 (CAS 104150-69-8) is a chemical compound with molecular formula C21H20O8 and molecular weight 400.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-(5-ethoxycarbonylfuran-2-yl)-6-ethyl-7-hydroxy-4-oxochromene-2-carboxylate
Also Known As: AB00397874-04, F0196-1424, ethyl 3-(5-(ethoxycarbonyl)furan-2-yl)-6-ethyl-7-hydroxy-4-oxo-4H-chromene-2-carboxylate, ethyl 3-[5-(ethoxycarbonyl)furan-2-yl]-6-ethyl-7-hydroxy-4-oxo-4H-chromene-2-carboxylate, ethyl 3-(5-ethoxycarbonylfuran-2-yl)-6-ethyl-7-hydroxy-4-oxochromene-2-carboxylate
| Molecular Formula | C21H20O8 |
|---|---|
| Molecular Weight | 400.12 g/mol |
| LogP | 3.6744 |
| Topological Polar Surface Area | 116.18 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 400.1158 |
| Heavy Atoms | 29 |
| Complexity | 1135.5239 |
Chemical Identifiers
| CAS Number | 104150-69-8 |
|---|---|
| SMILES | CCC1=CC2=C(C=C1O)OC(=C(C2=O)C3=CC=C(O3)C(=O)OCC)C(=O)OCC |
Product Overview
AB00397874-04 (CAS 104150-69-8), with molecular formula C21H20O8 and molecular weight 400.12 g/mol. IUPAC: ethyl 3-(5-ethoxycarbonylfuran-2-yl)-6-ethyl-7-hydroxy-4-oxochromene-2-carboxylate.
Chemical Property Profile of AB00397874-04
Property Insights of AB00397874-04
The XLogP value of 3.6744 indicates that AB00397874-04 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 116.18 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00397874-04. Following Lipinski's Rule of Five, AB00397874-04 has 1 hydrogen bond donor(s) and 8 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 AB00397874-04?
The CAS number of AB00397874-04 is 104150-69-8.
What is the molecular formula of AB00397874-04?
The molecular formula of AB00397874-04 is C21H20O8.
What is the molecular weight of AB00397874-04?
The molecular weight of AB00397874-04 is 400.12 g/mol.
Where can I buy AB00397874-04?
You can request a quote for AB00397874-04 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00397874-04?
Yes, KEHONG BIO provides custom synthesis services for AB00397874-04 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.