Ethyl 4-(9,10-dioxoanthracen-2-yl)-1,2-oxazole-3-carboxylate
TL;DR: Ethyl 4-(9,10-dioxoanthracen-2-yl)-1,2-oxazole-3-carboxylate (CAS 339101-03-0) is a chemical compound with molecular formula C20H13NO5 and molecular weight 347.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(9,10-dioxoanthracen-2-yl)-1,2-oxazole-3-carboxylate
Also Known As: Ethyl 4-(9,10-dioxoanthracen-2-yl)-1,2-oxazole-3-carboxylate, 8L-902, ethyl 4-(9,10-dioxo-9,10-dihydro-2-anthracenyl)-3-isoxazolecarboxylate, ethyl 4-(9,10-dioxo-9,10-dihydroanthracen-2-yl)-1,2-oxazole-3-carboxylate, ethyl4-(9,10-dioxo-9,10-dihydroanthracen-2-yl)-1,2-oxazole-3-carboxylate
| Molecular Formula | C20H13NO5 |
|---|---|
| Molecular Weight | 347.08 g/mol |
| LogP | 3.2937 |
| Topological Polar Surface Area | 86.47 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 347.07938 |
| Heavy Atoms | 26 |
| Complexity | 1063.5685 |
Chemical Identifiers
| CAS Number | 339101-03-0 |
|---|---|
| SMILES | CCOC(=O)C1=NOC=C1C2=CC3=C(C=C2)C(=O)C4=CC=CC=C4C3=O |
Product Overview
Ethyl 4-(9,10-dioxoanthracen-2-yl)-1,2-oxazole-3-carboxylate (CAS 339101-03-0), with molecular formula C20H13NO5 and molecular weight 347.08 g/mol. IUPAC: ethyl 4-(9,10-dioxoanthracen-2-yl)-1,2-oxazole-3-carboxylate.
Chemical Property Profile of Ethyl 4-(9,10-dioxoanthracen-2-yl)-1,2-oxazole-3-carboxylate
Property Insights of Ethyl 4-(9,10-dioxoanthracen-2-yl)-1,2-oxazole-3-carboxylate
The XLogP value of 3.2937 indicates that Ethyl 4-(9,10-dioxoanthracen-2-yl)-1,2-oxazole-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.47 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 4-(9,10-dioxoanthracen-2-yl)-1,2-oxazole-3-carboxylate. Following Lipinski's Rule of Five, Ethyl 4-(9,10-dioxoanthracen-2-yl)-1,2-oxazole-3-carboxylate has 0 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 Ethyl 4-(9,10-dioxoanthracen-2-yl)-1,2-oxazole-3-carboxylate?
The CAS number of Ethyl 4-(9,10-dioxoanthracen-2-yl)-1,2-oxazole-3-carboxylate is 339101-03-0.
What is the molecular formula of Ethyl 4-(9,10-dioxoanthracen-2-yl)-1,2-oxazole-3-carboxylate?
The molecular formula of Ethyl 4-(9,10-dioxoanthracen-2-yl)-1,2-oxazole-3-carboxylate is C20H13NO5.
What is the molecular weight of Ethyl 4-(9,10-dioxoanthracen-2-yl)-1,2-oxazole-3-carboxylate?
The molecular weight of Ethyl 4-(9,10-dioxoanthracen-2-yl)-1,2-oxazole-3-carboxylate is 347.08 g/mol.
Where can I buy Ethyl 4-(9,10-dioxoanthracen-2-yl)-1,2-oxazole-3-carboxylate?
You can request a quote for Ethyl 4-(9,10-dioxoanthracen-2-yl)-1,2-oxazole-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 4-(9,10-dioxoanthracen-2-yl)-1,2-oxazole-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-(9,10-dioxoanthracen-2-yl)-1,2-oxazole-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.