![3-((3-methoxypropyl)amino)-5-(phenylamino)-6H-anthra[1,9-cd]isoxazol-6-one structure](/static/products/396/396101-32-9.png)
3-((3-methoxypropyl)amino)-5-(phenylamino)-6H-anthra[1,9-cd]isoxazol-6-one
TL;DR: 3-((3-methoxypropyl)amino)-5-(phenylamino)-6H-anthra[1,9-cd]isoxazol-6-one (CAS 396101-32-9) is a chemical compound with molecular formula C24H21N3O3 and molecular weight 399.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
10-anilino-12-(3-methoxypropylamino)-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-((3-methoxypropyl)amino)-5-(phenylamino)-6H-anthra[1,9-cd]isoxazol-6-one, 3-[(3-methoxypropyl)amino]-5-(phenylamino)-6H-anthra[1,9-cd][1,2]oxazol-6-one
| Molecular Formula | C24H21N3O3 |
|---|---|
| Molecular Weight | 399.16 g/mol |
| LogP | 5.2312 |
| Topological Polar Surface Area | 76.39 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 399.1583 |
| Heavy Atoms | 30 |
| Complexity | 1231.4188 |
Chemical Identifiers
| CAS Number | 396101-32-9 |
|---|---|
| SMILES | COCCCNC1=CC(=C2C3=C(C4=CC=CC=C4C2=O)ON=C13)NC5=CC=CC=C5 |
Product Overview
3-((3-methoxypropyl)amino)-5-(phenylamino)-6H-anthra[1,9-cd]isoxazol-6-one (CAS 396101-32-9), with molecular formula C24H21N3O3 and molecular weight 399.16 g/mol. IUPAC: 10-anilino-12-(3-methoxypropylamino)-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-((3-methoxypropyl)amino)-5-(phenylamino)-6H-anthra[1,9-cd]isoxazol-6-one
Property Insights of 3-((3-methoxypropyl)amino)-5-(phenylamino)-6H-anthra[1,9-cd]isoxazol-6-one
The XLogP value of 5.2312 indicates that 3-((3-methoxypropyl)amino)-5-(phenylamino)-6H-anthra[1,9-cd]isoxazol-6-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.39 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-((3-methoxypropyl)amino)-5-(phenylamino)-6H-anthra[1,9-cd]isoxazol-6-one. Following Lipinski's Rule of Five, 3-((3-methoxypropyl)amino)-5-(phenylamino)-6H-anthra[1,9-cd]isoxazol-6-one has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-((3-methoxypropyl)amino)-5-(phenylamino)-6H-anthra[1,9-cd]isoxazol-6-one?
The CAS number of 3-((3-methoxypropyl)amino)-5-(phenylamino)-6H-anthra[1,9-cd]isoxazol-6-one is 396101-32-9.
What is the molecular formula of 3-((3-methoxypropyl)amino)-5-(phenylamino)-6H-anthra[1,9-cd]isoxazol-6-one?
The molecular formula of 3-((3-methoxypropyl)amino)-5-(phenylamino)-6H-anthra[1,9-cd]isoxazol-6-one is C24H21N3O3.
What is the molecular weight of 3-((3-methoxypropyl)amino)-5-(phenylamino)-6H-anthra[1,9-cd]isoxazol-6-one?
The molecular weight of 3-((3-methoxypropyl)amino)-5-(phenylamino)-6H-anthra[1,9-cd]isoxazol-6-one is 399.16 g/mol.
Where can I buy 3-((3-methoxypropyl)amino)-5-(phenylamino)-6H-anthra[1,9-cd]isoxazol-6-one?
You can request a quote for 3-((3-methoxypropyl)amino)-5-(phenylamino)-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-((3-methoxypropyl)amino)-5-(phenylamino)-6H-anthra[1,9-cd]isoxazol-6-one?
Yes, KEHONG BIO provides custom synthesis services for 3-((3-methoxypropyl)amino)-5-(phenylamino)-6H-anthra[1,9-cd]isoxazol-6-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.