![3,5-diphenoxy-6H-anthra[1,9-cd]isoxazol-6-one structure](/static/products/5476/5476-99-3.webp)
3,5-diphenoxy-6H-anthra[1,9-cd]isoxazol-6-one
TL;DR: 3,5-diphenoxy-6H-anthra[1,9-cd]isoxazol-6-one (CAS 5476-99-3) is a chemical compound with molecular formula C26H15NO4 and molecular weight 405.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
10,12-diphenoxy-15-oxa-14-azatetracyclo[7.6.1.02,7.013,16]hexadeca-1(16),2,4,6,9,11,13-heptaen-8-one
Also Known As: 3,5-diphenoxy-6H-anthra[1,9-cd]isoxazol-6-one, 3,5-diphenoxy-6H-anthra[1,9-cd][1,2]oxazol-6-one, RefChem:388673
| Molecular Formula | C26H15NO4 |
|---|---|
| Molecular Weight | 405.10 g/mol |
| LogP | 6.6238 |
| Topological Polar Surface Area | 61.56 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 405.1001 |
| Heavy Atoms | 31 |
| Complexity | 1439.0585 |
Chemical Identifiers
| CAS Number | 5476-99-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)OC2=CC(=C3C4=C(C5=CC=CC=C5C3=O)ON=C24)OC6=CC=CC=C6 |
Product Overview
3,5-diphenoxy-6H-anthra[1,9-cd]isoxazol-6-one (CAS 5476-99-3), with molecular formula C26H15NO4 and molecular weight 405.10 g/mol. IUPAC: 10,12-diphenoxy-15-oxa-14-azatetracyclo[7.6.1.02,7.013,16]hexadeca-1(16),2,4,6,9,11,13-heptaen-8-one.
Chemical Property Profile of 3,5-diphenoxy-6H-anthra[1,9-cd]isoxazol-6-one
Property Insights of 3,5-diphenoxy-6H-anthra[1,9-cd]isoxazol-6-one
The XLogP value of 6.6238 indicates that 3,5-diphenoxy-6H-anthra[1,9-cd]isoxazol-6-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.56 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,5-diphenoxy-6H-anthra[1,9-cd]isoxazol-6-one. Following Lipinski's Rule of Five, 3,5-diphenoxy-6H-anthra[1,9-cd]isoxazol-6-one has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3,5-diphenoxy-6H-anthra[1,9-cd]isoxazol-6-one?
The CAS number of 3,5-diphenoxy-6H-anthra[1,9-cd]isoxazol-6-one is 5476-99-3.
What is the molecular formula of 3,5-diphenoxy-6H-anthra[1,9-cd]isoxazol-6-one?
The molecular formula of 3,5-diphenoxy-6H-anthra[1,9-cd]isoxazol-6-one is C26H15NO4.
What is the molecular weight of 3,5-diphenoxy-6H-anthra[1,9-cd]isoxazol-6-one?
The molecular weight of 3,5-diphenoxy-6H-anthra[1,9-cd]isoxazol-6-one is 405.10 g/mol.
Where can I buy 3,5-diphenoxy-6H-anthra[1,9-cd]isoxazol-6-one?
You can request a quote for 3,5-diphenoxy-6H-anthra[1,9-cd]isoxazol-6-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5-diphenoxy-6H-anthra[1,9-cd]isoxazol-6-one?
Yes, KEHONG BIO provides custom synthesis services for 3,5-diphenoxy-6H-anthra[1,9-cd]isoxazol-6-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.