3-(2-(Benzyloxy)-3,4-dimethoxyphenyl)-7-methoxy-4H-chromen-4-one
TL;DR: 3-(2-(Benzyloxy)-3,4-dimethoxyphenyl)-7-methoxy-4H-chromen-4-one (CAS 79592-96-4) is a chemical compound with molecular formula C25H22O6 and molecular weight 418.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3,4-dimethoxy-2-phenylmethoxyphenyl)-7-methoxychromen-4-one
Also Known As: 3-(2-(Benzyloxy)-3,4-dimethoxyphenyl)-7-methoxy-4H-chromen-4-one, 3-(2-benzyloxy-3,4-dimethoxy-phenyl)-7-methoxy-chromen-4-one, 3-(3,4-dimethoxy-2-phenylmethoxyphenyl)-7-methoxychromen-4-o, 3-(3,4-dimethoxy-2-phenylmethoxyphenyl)-7-methoxychromen-4-one, 3-[2-(Benzyloxy)-3,4-dimethoxyphenyl]-7-methoxy-4H-1-benzopyran-4-one
| Molecular Formula | C25H22O6 |
|---|---|
| Molecular Weight | 418.14 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 63.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 418.14163 |
| Heavy Atoms | 31 |
| Complexity | 628.0 |
Chemical Identifiers
| CAS Number | 79592-96-4 |
|---|---|
| SMILES | COC1=CC2=C(C=C1)C(=O)C(=CO2)C3=C(C(=C(C=C3)OC)OC)OCC4=CC=CC=C4 |
| InChIKey | YSMQXJKDMNGBDX-UHFFFAOYSA-N |
Product Overview
3-(2-(Benzyloxy)-3,4-dimethoxyphenyl)-7-methoxy-4H-chromen-4-one (CAS 79592-96-4), with molecular formula C25H22O6 and molecular weight 418.14 g/mol. IUPAC: 3-(3,4-dimethoxy-2-phenylmethoxyphenyl)-7-methoxychromen-4-one.
Chemical Property Profile of 3-(2-(Benzyloxy)-3,4-dimethoxyphenyl)-7-methoxy-4H-chromen-4-one
Property Insights of 3-(2-(Benzyloxy)-3,4-dimethoxyphenyl)-7-methoxy-4H-chromen-4-one
The XLogP value of 4.6 indicates that 3-(2-(Benzyloxy)-3,4-dimethoxyphenyl)-7-methoxy-4H-chromen-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(2-(Benzyloxy)-3,4-dimethoxyphenyl)-7-methoxy-4H-chromen-4-one. Following Lipinski's Rule of Five, 3-(2-(Benzyloxy)-3,4-dimethoxyphenyl)-7-methoxy-4H-chromen-4-one 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 3-(2-(Benzyloxy)-3,4-dimethoxyphenyl)-7-methoxy-4H-chromen-4-one?
The CAS number of 3-(2-(Benzyloxy)-3,4-dimethoxyphenyl)-7-methoxy-4H-chromen-4-one is 79592-96-4.
What is the molecular formula of 3-(2-(Benzyloxy)-3,4-dimethoxyphenyl)-7-methoxy-4H-chromen-4-one?
The molecular formula of 3-(2-(Benzyloxy)-3,4-dimethoxyphenyl)-7-methoxy-4H-chromen-4-one is C25H22O6.
What is the molecular weight of 3-(2-(Benzyloxy)-3,4-dimethoxyphenyl)-7-methoxy-4H-chromen-4-one?
The molecular weight of 3-(2-(Benzyloxy)-3,4-dimethoxyphenyl)-7-methoxy-4H-chromen-4-one is 418.14 g/mol.
Where can I buy 3-(2-(Benzyloxy)-3,4-dimethoxyphenyl)-7-methoxy-4H-chromen-4-one?
You can request a quote for 3-(2-(Benzyloxy)-3,4-dimethoxyphenyl)-7-methoxy-4H-chromen-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2-(Benzyloxy)-3,4-dimethoxyphenyl)-7-methoxy-4H-chromen-4-one?
Yes, KEHONG BIO provides custom synthesis services for 3-(2-(Benzyloxy)-3,4-dimethoxyphenyl)-7-methoxy-4H-chromen-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.