![5-(cyclohexylamino)-6H-anthra[1,9-cd]isoxazol-6-one structure](/static/products/808/80825-47-4.png)
5-(cyclohexylamino)-6H-anthra[1,9-cd]isoxazol-6-one
TL;DR: 5-(cyclohexylamino)-6H-anthra[1,9-cd]isoxazol-6-one (CAS 80825-47-4) is a chemical compound with molecular formula C20H18N2O2 and molecular weight 318.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
10-(cyclohexylamino)-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: BIM-0021072.P001, 5-(cyclohexylamino)-6H-anthra[1,9-cd]isoxazol-6-one, 6H-Anthra[1,9-cd]isoxazol-6-one, 5-(cyclohexylamino)-, 5-(cyclohexylamino)-6H-anthra[1,9-cd][1,2]oxazol-6-one, 10-(CYCLOHEXYLAMINO)-15-OXA-14-AZATETRACYCLO[7.6.1.0(2),?.0(1)(3),(1)?]HEXADECA-1(16),2,4,6,9,11,13-HEPTAEN-8-ONE
| Molecular Formula | C20H18N2O2 |
|---|---|
| Molecular Weight | 318.14 g/mol |
| LogP | 4.7838 |
| Topological Polar Surface Area | 55.13 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 318.13684 |
| Heavy Atoms | 24 |
| Complexity | 951.4273 |
Chemical Identifiers
| CAS Number | 80825-47-4 |
|---|---|
| SMILES | C1CCC(CC1)NC2=C3C4=C(C5=CC=CC=C5C3=O)ON=C4C=C2 |
Product Overview
5-(cyclohexylamino)-6H-anthra[1,9-cd]isoxazol-6-one (CAS 80825-47-4), with molecular formula C20H18N2O2 and molecular weight 318.14 g/mol. IUPAC: 10-(cyclohexylamino)-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 5-(cyclohexylamino)-6H-anthra[1,9-cd]isoxazol-6-one
Property Insights of 5-(cyclohexylamino)-6H-anthra[1,9-cd]isoxazol-6-one
The XLogP value of 4.7838 indicates that 5-(cyclohexylamino)-6H-anthra[1,9-cd]isoxazol-6-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.13 Ų, 5-(cyclohexylamino)-6H-anthra[1,9-cd]isoxazol-6-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(cyclohexylamino)-6H-anthra[1,9-cd]isoxazol-6-one 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 5-(cyclohexylamino)-6H-anthra[1,9-cd]isoxazol-6-one?
The CAS number of 5-(cyclohexylamino)-6H-anthra[1,9-cd]isoxazol-6-one is 80825-47-4.
What is the molecular formula of 5-(cyclohexylamino)-6H-anthra[1,9-cd]isoxazol-6-one?
The molecular formula of 5-(cyclohexylamino)-6H-anthra[1,9-cd]isoxazol-6-one is C20H18N2O2.
What is the molecular weight of 5-(cyclohexylamino)-6H-anthra[1,9-cd]isoxazol-6-one?
The molecular weight of 5-(cyclohexylamino)-6H-anthra[1,9-cd]isoxazol-6-one is 318.14 g/mol.
Where can I buy 5-(cyclohexylamino)-6H-anthra[1,9-cd]isoxazol-6-one?
You can request a quote for 5-(cyclohexylamino)-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 5-(cyclohexylamino)-6H-anthra[1,9-cd]isoxazol-6-one?
Yes, KEHONG BIO provides custom synthesis services for 5-(cyclohexylamino)-6H-anthra[1,9-cd]isoxazol-6-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.