![7-[3-(4-Bromo-phenyl)-4,5-dihydro-isoxazol-5-ylmethoxy]-4-methyl-chromen-2-one structure](/static/products/899/899408-10-7.png)
7-[3-(4-Bromo-phenyl)-4,5-dihydro-isoxazol-5-ylmethoxy]-4-methyl-chromen-2-one
TL;DR: 7-[3-(4-Bromo-phenyl)-4,5-dihydro-isoxazol-5-ylmethoxy]-4-methyl-chromen-2-one (CAS 899408-10-7) is a chemical compound with molecular formula C20H16BrNO4 and molecular weight 413.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-[[3-(4-bromophenyl)-4,5-dihydro-1,2-oxazol-5-yl]methoxy]-4-methylchromen-2-one
Also Known As: 7-((3-(4-bromophenyl)-4,5-dihydroisoxazol-5-yl)methoxy)-4-methyl-2H-chromen-2-one, 7-[[3-(4-bromophenyl)-4,5-dihydro-1,2-oxazol-5-yl]methoxy]-4-methylchromen-2-one, 7-[3-(4-Bromo-phenyl)-4,5-dihydro-isoxazol-5-ylmethoxy]-4-methyl-chromen-2-one, 7-{[3-(4-bromophenyl)-4,5-dihydro-1,2-oxazol-5-yl]methoxy}-4-methyl-2H-chromen-2-one
| Molecular Formula | C20H16BrNO4 |
|---|---|
| Molecular Weight | 413.03 g/mol |
| LogP | 4.43592 |
| Topological Polar Surface Area | 61.03 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 413.02628 |
| Heavy Atoms | 26 |
| Complexity | 1039.8557 |
Chemical Identifiers
| CAS Number | 899408-10-7 |
|---|---|
| SMILES | CC1=CC(=O)OC2=C1C=CC(=C2)OCC3CC(=NO3)C4=CC=C(C=C4)Br |
Product Overview
7-[3-(4-Bromo-phenyl)-4,5-dihydro-isoxazol-5-ylmethoxy]-4-methyl-chromen-2-one (CAS 899408-10-7), with molecular formula C20H16BrNO4 and molecular weight 413.03 g/mol. IUPAC: 7-[[3-(4-bromophenyl)-4,5-dihydro-1,2-oxazol-5-yl]methoxy]-4-methylchromen-2-one.
Chemical Property Profile of 7-[3-(4-Bromo-phenyl)-4,5-dihydro-isoxazol-5-ylmethoxy]-4-methyl-chromen-2-one
Property Insights of 7-[3-(4-Bromo-phenyl)-4,5-dihydro-isoxazol-5-ylmethoxy]-4-methyl-chromen-2-one
The XLogP value of 4.43592 indicates that 7-[3-(4-Bromo-phenyl)-4,5-dihydro-isoxazol-5-ylmethoxy]-4-methyl-chromen-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.03 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-[3-(4-Bromo-phenyl)-4,5-dihydro-isoxazol-5-ylmethoxy]-4-methyl-chromen-2-one. Following Lipinski's Rule of Five, 7-[3-(4-Bromo-phenyl)-4,5-dihydro-isoxazol-5-ylmethoxy]-4-methyl-chromen-2-one has 0 hydrogen bond donor(s) and 5 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 7-[3-(4-Bromo-phenyl)-4,5-dihydro-isoxazol-5-ylmethoxy]-4-methyl-chromen-2-one?
The CAS number of 7-[3-(4-Bromo-phenyl)-4,5-dihydro-isoxazol-5-ylmethoxy]-4-methyl-chromen-2-one is 899408-10-7.
What is the molecular formula of 7-[3-(4-Bromo-phenyl)-4,5-dihydro-isoxazol-5-ylmethoxy]-4-methyl-chromen-2-one?
The molecular formula of 7-[3-(4-Bromo-phenyl)-4,5-dihydro-isoxazol-5-ylmethoxy]-4-methyl-chromen-2-one is C20H16BrNO4.
What is the molecular weight of 7-[3-(4-Bromo-phenyl)-4,5-dihydro-isoxazol-5-ylmethoxy]-4-methyl-chromen-2-one?
The molecular weight of 7-[3-(4-Bromo-phenyl)-4,5-dihydro-isoxazol-5-ylmethoxy]-4-methyl-chromen-2-one is 413.03 g/mol.
Where can I buy 7-[3-(4-Bromo-phenyl)-4,5-dihydro-isoxazol-5-ylmethoxy]-4-methyl-chromen-2-one?
You can request a quote for 7-[3-(4-Bromo-phenyl)-4,5-dihydro-isoxazol-5-ylmethoxy]-4-methyl-chromen-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-[3-(4-Bromo-phenyl)-4,5-dihydro-isoxazol-5-ylmethoxy]-4-methyl-chromen-2-one?
Yes, KEHONG BIO provides custom synthesis services for 7-[3-(4-Bromo-phenyl)-4,5-dihydro-isoxazol-5-ylmethoxy]-4-methyl-chromen-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.