methyl 4-((7-((4-bromobenzyl)oxy)-4-oxo-4H-chromen-3-yl)oxy)benzoate
TL;DR: methyl 4-((7-((4-bromobenzyl)oxy)-4-oxo-4H-chromen-3-yl)oxy)benzoate (CAS 845665-87-4) is a chemical compound with molecular formula C24H17BrO6 and molecular weight 480.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[7-[(4-bromophenyl)methoxy]-4-oxochromen-3-yl]oxybenzoate
Also Known As: AB01276541-01, methyl 4-((7-((4-bromobenzyl)oxy)-4-oxo-4H-chromen-3-yl)oxy)benzoate, methyl 4-[7-[(4-bromophenyl)methoxy]-4-oxochromen-3-yl]oxybenzoate, methyl 4-{7-[(4-bromophenyl)methoxy]-4-oxochromen-3-yloxy}benzoate, methyl 4-({7-[(4-bromobenzyl)oxy]-4-oxo-4H-chromen-3-yl}oxy)benzoate
| Molecular Formula | C24H17BrO6 |
|---|---|
| Molecular Weight | 480.02 g/mol |
| LogP | 5.7134 |
| Topological Polar Surface Area | 74.97 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 480.02084 |
| Heavy Atoms | 31 |
| Complexity | 1276.46 |
Chemical Identifiers
| CAS Number | 845665-87-4 |
|---|---|
| SMILES | COC(=O)C1=CC=C(C=C1)OC2=COC3=C(C2=O)C=CC(=C3)OCC4=CC=C(C=C4)Br |
Product Overview
methyl 4-((7-((4-bromobenzyl)oxy)-4-oxo-4H-chromen-3-yl)oxy)benzoate (CAS 845665-87-4), with molecular formula C24H17BrO6 and molecular weight 480.02 g/mol. IUPAC: methyl 4-[7-[(4-bromophenyl)methoxy]-4-oxochromen-3-yl]oxybenzoate.
Chemical Property Profile of methyl 4-((7-((4-bromobenzyl)oxy)-4-oxo-4H-chromen-3-yl)oxy)benzoate
Property Insights of methyl 4-((7-((4-bromobenzyl)oxy)-4-oxo-4H-chromen-3-yl)oxy)benzoate
The XLogP value of 5.7134 indicates that methyl 4-((7-((4-bromobenzyl)oxy)-4-oxo-4H-chromen-3-yl)oxy)benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.97 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 4-((7-((4-bromobenzyl)oxy)-4-oxo-4H-chromen-3-yl)oxy)benzoate. Following Lipinski's Rule of Five, methyl 4-((7-((4-bromobenzyl)oxy)-4-oxo-4H-chromen-3-yl)oxy)benzoate has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of methyl 4-((7-((4-bromobenzyl)oxy)-4-oxo-4H-chromen-3-yl)oxy)benzoate?
The CAS number of methyl 4-((7-((4-bromobenzyl)oxy)-4-oxo-4H-chromen-3-yl)oxy)benzoate is 845665-87-4.
What is the molecular formula of methyl 4-((7-((4-bromobenzyl)oxy)-4-oxo-4H-chromen-3-yl)oxy)benzoate?
The molecular formula of methyl 4-((7-((4-bromobenzyl)oxy)-4-oxo-4H-chromen-3-yl)oxy)benzoate is C24H17BrO6.
What is the molecular weight of methyl 4-((7-((4-bromobenzyl)oxy)-4-oxo-4H-chromen-3-yl)oxy)benzoate?
The molecular weight of methyl 4-((7-((4-bromobenzyl)oxy)-4-oxo-4H-chromen-3-yl)oxy)benzoate is 480.02 g/mol.
Where can I buy methyl 4-((7-((4-bromobenzyl)oxy)-4-oxo-4H-chromen-3-yl)oxy)benzoate?
You can request a quote for methyl 4-((7-((4-bromobenzyl)oxy)-4-oxo-4H-chromen-3-yl)oxy)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 4-((7-((4-bromobenzyl)oxy)-4-oxo-4H-chromen-3-yl)oxy)benzoate?
Yes, KEHONG BIO provides custom synthesis services for methyl 4-((7-((4-bromobenzyl)oxy)-4-oxo-4H-chromen-3-yl)oxy)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.