![2-[(3-bromo-6-oxo-6H-anthra[1,9-cd][1,2]oxazol-5-yl)amino]ethyl propanoate structure](/static/products/368/368840-53-3.png)
2-[(3-bromo-6-oxo-6H-anthra[1,9-cd][1,2]oxazol-5-yl)amino]ethyl propanoate
TL;DR: 2-[(3-bromo-6-oxo-6H-anthra[1,9-cd][1,2]oxazol-5-yl)amino]ethyl propanoate (CAS 368840-53-3) is a chemical compound with molecular formula C19H15BrN2O4 and molecular weight 414.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(12-bromo-8-oxo-15-oxa-14-azatetracyclo[7.6.1.02,7.013,16]hexadeca-1(16),2,4,6,9,11,13-heptaen-10-yl)amino]ethyl propanoate
Also Known As: 2-[(3-bromo-6-oxo-6H-anthra[1,9-cd][1,2]oxazol-5-yl)amino]ethyl propanoate, 2-((3-bromo-6-oxo-6H-anthra[1,9-cd]isoxazol-5-yl)amino)ethyl propionate
| Molecular Formula | C19H15BrN2O4 |
|---|---|
| Molecular Weight | 414.02 g/mol |
| LogP | 4.1668 |
| Topological Polar Surface Area | 81.43 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 414.0215 |
| Heavy Atoms | 26 |
| Complexity | 1041.4403 |
Chemical Identifiers
| CAS Number | 368840-53-3 |
|---|---|
| SMILES | CCC(=O)OCCNC1=C2C3=C(C4=CC=CC=C4C2=O)ON=C3C(=C1)Br |
Product Overview
2-[(3-bromo-6-oxo-6H-anthra[1,9-cd][1,2]oxazol-5-yl)amino]ethyl propanoate (CAS 368840-53-3), with molecular formula C19H15BrN2O4 and molecular weight 414.02 g/mol. IUPAC: 2-[(12-bromo-8-oxo-15-oxa-14-azatetracyclo[7.6.1.02,7.013,16]hexadeca-1(16),2,4,6,9,11,13-heptaen-10-yl)amino]ethyl propanoate.
Chemical Property Profile of 2-[(3-bromo-6-oxo-6H-anthra[1,9-cd][1,2]oxazol-5-yl)amino]ethyl propanoate
Property Insights of 2-[(3-bromo-6-oxo-6H-anthra[1,9-cd][1,2]oxazol-5-yl)amino]ethyl propanoate
The XLogP value of 4.1668 indicates that 2-[(3-bromo-6-oxo-6H-anthra[1,9-cd][1,2]oxazol-5-yl)amino]ethyl propanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.43 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(3-bromo-6-oxo-6H-anthra[1,9-cd][1,2]oxazol-5-yl)amino]ethyl propanoate. Following Lipinski's Rule of Five, 2-[(3-bromo-6-oxo-6H-anthra[1,9-cd][1,2]oxazol-5-yl)amino]ethyl propanoate has 1 hydrogen bond donor(s) and 6 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 2-[(3-bromo-6-oxo-6H-anthra[1,9-cd][1,2]oxazol-5-yl)amino]ethyl propanoate?
The CAS number of 2-[(3-bromo-6-oxo-6H-anthra[1,9-cd][1,2]oxazol-5-yl)amino]ethyl propanoate is 368840-53-3.
What is the molecular formula of 2-[(3-bromo-6-oxo-6H-anthra[1,9-cd][1,2]oxazol-5-yl)amino]ethyl propanoate?
The molecular formula of 2-[(3-bromo-6-oxo-6H-anthra[1,9-cd][1,2]oxazol-5-yl)amino]ethyl propanoate is C19H15BrN2O4.
What is the molecular weight of 2-[(3-bromo-6-oxo-6H-anthra[1,9-cd][1,2]oxazol-5-yl)amino]ethyl propanoate?
The molecular weight of 2-[(3-bromo-6-oxo-6H-anthra[1,9-cd][1,2]oxazol-5-yl)amino]ethyl propanoate is 414.02 g/mol.
Where can I buy 2-[(3-bromo-6-oxo-6H-anthra[1,9-cd][1,2]oxazol-5-yl)amino]ethyl propanoate?
You can request a quote for 2-[(3-bromo-6-oxo-6H-anthra[1,9-cd][1,2]oxazol-5-yl)amino]ethyl propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(3-bromo-6-oxo-6H-anthra[1,9-cd][1,2]oxazol-5-yl)amino]ethyl propanoate?
Yes, KEHONG BIO provides custom synthesis services for 2-[(3-bromo-6-oxo-6H-anthra[1,9-cd][1,2]oxazol-5-yl)amino]ethyl propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.