![6-oxo-N-(o-tolyl)-6H-anthra[1,9-cd]isoxazole-3-carboxamide structure](/static/products/899/89972-38-3.png)
6-oxo-N-(o-tolyl)-6H-anthra[1,9-cd]isoxazole-3-carboxamide
TL;DR: 6-oxo-N-(o-tolyl)-6H-anthra[1,9-cd]isoxazole-3-carboxamide (CAS 89972-38-3) is a chemical compound with molecular formula C22H14N2O3 and molecular weight 354.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-methylphenyl)-8-oxo-15-oxa-14-azatetracyclo[7.6.1.02,7.013,16]hexadeca-1(16),2,4,6,9,11,13-heptaene-12-carboxamide
Also Known As: ChemDiv1_019097, 6-oxo-N-(o-tolyl)-6H-anthra[1,9-cd]isoxazole-3-carboxamide, N-(2-methylphenyl)-6-oxo-6H-anthra[1,9-cd]isoxazole-3-carboxamide, N-(2-methylphenyl)-6-oxo-6H-anthra[1,9-cd][1,2]oxazole-3-carboxamide
| Molecular Formula | C22H14N2O3 |
|---|---|
| Molecular Weight | 354.10 g/mol |
| LogP | 4.59992 |
| Topological Polar Surface Area | 72.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 354.10043 |
| Heavy Atoms | 27 |
| Complexity | 1253.6454 |
Chemical Identifiers
| CAS Number | 89972-38-3 |
|---|---|
| SMILES | CC1=CC=CC=C1NC(=O)C2=CC=C3C4=C(C5=CC=CC=C5C3=O)ON=C24 |
Product Overview
6-oxo-N-(o-tolyl)-6H-anthra[1,9-cd]isoxazole-3-carboxamide (CAS 89972-38-3), with molecular formula C22H14N2O3 and molecular weight 354.10 g/mol. IUPAC: N-(2-methylphenyl)-8-oxo-15-oxa-14-azatetracyclo[7.6.1.02,7.013,16]hexadeca-1(16),2,4,6,9,11,13-heptaene-12-carboxamide.
Chemical Property Profile of 6-oxo-N-(o-tolyl)-6H-anthra[1,9-cd]isoxazole-3-carboxamide
Property Insights of 6-oxo-N-(o-tolyl)-6H-anthra[1,9-cd]isoxazole-3-carboxamide
The XLogP value of 4.59992 indicates that 6-oxo-N-(o-tolyl)-6H-anthra[1,9-cd]isoxazole-3-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-oxo-N-(o-tolyl)-6H-anthra[1,9-cd]isoxazole-3-carboxamide. Following Lipinski's Rule of Five, 6-oxo-N-(o-tolyl)-6H-anthra[1,9-cd]isoxazole-3-carboxamide has 1 hydrogen bond donor(s) and 4 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 6-oxo-N-(o-tolyl)-6H-anthra[1,9-cd]isoxazole-3-carboxamide?
The CAS number of 6-oxo-N-(o-tolyl)-6H-anthra[1,9-cd]isoxazole-3-carboxamide is 89972-38-3.
What is the molecular formula of 6-oxo-N-(o-tolyl)-6H-anthra[1,9-cd]isoxazole-3-carboxamide?
The molecular formula of 6-oxo-N-(o-tolyl)-6H-anthra[1,9-cd]isoxazole-3-carboxamide is C22H14N2O3.
What is the molecular weight of 6-oxo-N-(o-tolyl)-6H-anthra[1,9-cd]isoxazole-3-carboxamide?
The molecular weight of 6-oxo-N-(o-tolyl)-6H-anthra[1,9-cd]isoxazole-3-carboxamide is 354.10 g/mol.
Where can I buy 6-oxo-N-(o-tolyl)-6H-anthra[1,9-cd]isoxazole-3-carboxamide?
You can request a quote for 6-oxo-N-(o-tolyl)-6H-anthra[1,9-cd]isoxazole-3-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-oxo-N-(o-tolyl)-6H-anthra[1,9-cd]isoxazole-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 6-oxo-N-(o-tolyl)-6H-anthra[1,9-cd]isoxazole-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.