5-(phenylamino)-3-(piperidin-1-yl)-6H-anthra[1,9-cd]isoxazol-6-one
TL;DR: 5-(phenylamino)-3-(piperidin-1-yl)-6H-anthra[1,9-cd]isoxazol-6-one (CAS 75753-48-9) is a chemical compound with molecular formula C25H21N3O2 and molecular weight 395.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
10-anilino-12-piperidin-1-yl-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: ChemDiv1_019091, 5-(phenylamino)-3-(piperidin-1-yl)-6H-anthra[1,9-cd]isoxazol-6-one, 5-ANILINO-3-PIPERIDINO-6H-ANTHRA[1,9-CD]ISOXAZOL-6-ONE, 5-(phenylamino)-3-(piperidin-1-yl)-6H-anthra[1,9-cd][1,2]oxazol-6-one
| Molecular Formula | C25H21N3O2 |
|---|---|
| Molecular Weight | 395.16 g/mol |
| LogP | 5.7731 |
| Topological Polar Surface Area | 58.37 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 395.1634 |
| Heavy Atoms | 30 |
| Complexity | 1270.5483 |
Chemical Identifiers
| CAS Number | 75753-48-9 |
|---|---|
| SMILES | C1CCN(CC1)C2=CC(=C3C4=C(C5=CC=CC=C5C3=O)ON=C24)NC6=CC=CC=C6 |
Product Overview
5-(phenylamino)-3-(piperidin-1-yl)-6H-anthra[1,9-cd]isoxazol-6-one (CAS 75753-48-9), with molecular formula C25H21N3O2 and molecular weight 395.16 g/mol. IUPAC: 10-anilino-12-piperidin-1-yl-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-(phenylamino)-3-(piperidin-1-yl)-6H-anthra[1,9-cd]isoxazol-6-one
Property Insights of 5-(phenylamino)-3-(piperidin-1-yl)-6H-anthra[1,9-cd]isoxazol-6-one
The XLogP value of 5.7731 indicates that 5-(phenylamino)-3-(piperidin-1-yl)-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 58.37 Ų, 5-(phenylamino)-3-(piperidin-1-yl)-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-(phenylamino)-3-(piperidin-1-yl)-6H-anthra[1,9-cd]isoxazol-6-one has 1 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 5-(phenylamino)-3-(piperidin-1-yl)-6H-anthra[1,9-cd]isoxazol-6-one?
The CAS number of 5-(phenylamino)-3-(piperidin-1-yl)-6H-anthra[1,9-cd]isoxazol-6-one is 75753-48-9.
What is the molecular formula of 5-(phenylamino)-3-(piperidin-1-yl)-6H-anthra[1,9-cd]isoxazol-6-one?
The molecular formula of 5-(phenylamino)-3-(piperidin-1-yl)-6H-anthra[1,9-cd]isoxazol-6-one is C25H21N3O2.
What is the molecular weight of 5-(phenylamino)-3-(piperidin-1-yl)-6H-anthra[1,9-cd]isoxazol-6-one?
The molecular weight of 5-(phenylamino)-3-(piperidin-1-yl)-6H-anthra[1,9-cd]isoxazol-6-one is 395.16 g/mol.
Where can I buy 5-(phenylamino)-3-(piperidin-1-yl)-6H-anthra[1,9-cd]isoxazol-6-one?
You can request a quote for 5-(phenylamino)-3-(piperidin-1-yl)-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-(phenylamino)-3-(piperidin-1-yl)-6H-anthra[1,9-cd]isoxazol-6-one?
Yes, KEHONG BIO provides custom synthesis services for 5-(phenylamino)-3-(piperidin-1-yl)-6H-anthra[1,9-cd]isoxazol-6-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.