2-[3-(acetyloxy)-4-(benzyloxy)phenyl]-3,7-dimethoxy-4-oxo-4H-chromen-5-yl acetate
TL;DR: 2-[3-(acetyloxy)-4-(benzyloxy)phenyl]-3,7-dimethoxy-4-oxo-4H-chromen-5-yl acetate (CAS 56606-54-3) is a chemical compound with molecular formula C26H24O8 and molecular weight 464.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-hydroxy-3,7-dimethoxy-2-[3-(methoxymethoxy)-4-phenylmethoxyphenyl]chromen-4-one
Also Known As: 2-[3-(acetyloxy)-4-(benzyloxy)phenyl]-3,7-dimethoxy-4-oxo-4H-chromen-5-yl acetate, 2-(4-(Benzyloxy)-3-(methoxymethoxy)phenyl)-5-hydroxy-3,7-dimethoxy-4H-chromen-4-one, 5-hydroxy-3,7-dimethoxy-2-[3-(methoxymethoxy)-4-phenylmethoxy-phenyl]chromen-4-one, 5-hydroxy-3,7-dimethoxy-2-[3-(methoxymethoxy)-4-phenylmethoxyphenyl]chromen-4-one
| Molecular Formula | C26H24O8 |
|---|---|
| Molecular Weight | 464.15 g/mol |
| LogP | 4.7445 |
| Topological Polar Surface Area | 96.59 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 464.14713 |
| Heavy Atoms | 34 |
| Complexity | 1344.7585 |
Chemical Identifiers
| CAS Number | 56606-54-3 |
|---|---|
| SMILES | COCOC1=C(C=CC(=C1)C2=C(C(=O)C3=C(C=C(C=C3O2)OC)O)OC)OCC4=CC=CC=C4 |
Product Overview
2-[3-(acetyloxy)-4-(benzyloxy)phenyl]-3,7-dimethoxy-4-oxo-4H-chromen-5-yl acetate (CAS 56606-54-3), with molecular formula C26H24O8 and molecular weight 464.15 g/mol. IUPAC: 5-hydroxy-3,7-dimethoxy-2-[3-(methoxymethoxy)-4-phenylmethoxyphenyl]chromen-4-one.
Chemical Property Profile of 2-[3-(acetyloxy)-4-(benzyloxy)phenyl]-3,7-dimethoxy-4-oxo-4H-chromen-5-yl acetate
Property Insights of 2-[3-(acetyloxy)-4-(benzyloxy)phenyl]-3,7-dimethoxy-4-oxo-4H-chromen-5-yl acetate
The XLogP value of 4.7445 indicates that 2-[3-(acetyloxy)-4-(benzyloxy)phenyl]-3,7-dimethoxy-4-oxo-4H-chromen-5-yl acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.59 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[3-(acetyloxy)-4-(benzyloxy)phenyl]-3,7-dimethoxy-4-oxo-4H-chromen-5-yl acetate. Following Lipinski's Rule of Five, 2-[3-(acetyloxy)-4-(benzyloxy)phenyl]-3,7-dimethoxy-4-oxo-4H-chromen-5-yl acetate 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 2-[3-(acetyloxy)-4-(benzyloxy)phenyl]-3,7-dimethoxy-4-oxo-4H-chromen-5-yl acetate?
The CAS number of 2-[3-(acetyloxy)-4-(benzyloxy)phenyl]-3,7-dimethoxy-4-oxo-4H-chromen-5-yl acetate is 56606-54-3.
What is the molecular formula of 2-[3-(acetyloxy)-4-(benzyloxy)phenyl]-3,7-dimethoxy-4-oxo-4H-chromen-5-yl acetate?
The molecular formula of 2-[3-(acetyloxy)-4-(benzyloxy)phenyl]-3,7-dimethoxy-4-oxo-4H-chromen-5-yl acetate is C26H24O8.
What is the molecular weight of 2-[3-(acetyloxy)-4-(benzyloxy)phenyl]-3,7-dimethoxy-4-oxo-4H-chromen-5-yl acetate?
The molecular weight of 2-[3-(acetyloxy)-4-(benzyloxy)phenyl]-3,7-dimethoxy-4-oxo-4H-chromen-5-yl acetate is 464.15 g/mol.
Where can I buy 2-[3-(acetyloxy)-4-(benzyloxy)phenyl]-3,7-dimethoxy-4-oxo-4H-chromen-5-yl acetate?
You can request a quote for 2-[3-(acetyloxy)-4-(benzyloxy)phenyl]-3,7-dimethoxy-4-oxo-4H-chromen-5-yl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[3-(acetyloxy)-4-(benzyloxy)phenyl]-3,7-dimethoxy-4-oxo-4H-chromen-5-yl acetate?
Yes, KEHONG BIO provides custom synthesis services for 2-[3-(acetyloxy)-4-(benzyloxy)phenyl]-3,7-dimethoxy-4-oxo-4H-chromen-5-yl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.