Ethyl 5-(tributylstannyl)-1,2-oxazole-3-carboxylate
TL;DR: Ethyl 5-(tributylstannyl)-1,2-oxazole-3-carboxylate (CAS 126085-91-4) is a chemical compound with molecular formula C18H33NO3Sn and molecular weight 431.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-tributylstannyl-1,2-oxazole-3-carboxylate
Also Known As: Ethyl 5-(tributylstannyl)isoxazole-3-carboxylate, Ethyl 5-tributylstannyl-1,2-oxazole-3-carboxylate, Ethyl-5-(tributylstannyl)isoxazole-3-carboxylate, 3291AD, 3-Isoxazolecarboxylic acid, 5-(tributylstannyl)-, ethyl ester
| Molecular Formula | C18H33NO3Sn |
|---|---|
| Molecular Weight | 431.15 g/mol |
| LogP | 4.9074 |
| Topological Polar Surface Area | 52.33 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 12 |
| Exact Mass | 431.14825 |
| Heavy Atoms | 23 |
| Complexity | 437.09967 |
Chemical Identifiers
| CAS Number | 126085-91-4 |
|---|---|
| SMILES | CCCC[Sn](CCCC)(CCCC)C1=CC(=NO1)C(=O)OCC |
Product Overview
Ethyl 5-(tributylstannyl)-1,2-oxazole-3-carboxylate (CAS 126085-91-4), with molecular formula C18H33NO3Sn and molecular weight 431.15 g/mol. IUPAC: ethyl 5-tributylstannyl-1,2-oxazole-3-carboxylate.
Chemical Property Profile of Ethyl 5-(tributylstannyl)-1,2-oxazole-3-carboxylate
Property Insights of Ethyl 5-(tributylstannyl)-1,2-oxazole-3-carboxylate
The XLogP value of 4.9074 indicates that Ethyl 5-(tributylstannyl)-1,2-oxazole-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.33 Ų, Ethyl 5-(tributylstannyl)-1,2-oxazole-3-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 5-(tributylstannyl)-1,2-oxazole-3-carboxylate has 0 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 Ethyl 5-(tributylstannyl)-1,2-oxazole-3-carboxylate?
The CAS number of Ethyl 5-(tributylstannyl)-1,2-oxazole-3-carboxylate is 126085-91-4.
What is the molecular formula of Ethyl 5-(tributylstannyl)-1,2-oxazole-3-carboxylate?
The molecular formula of Ethyl 5-(tributylstannyl)-1,2-oxazole-3-carboxylate is C18H33NO3Sn.
What is the molecular weight of Ethyl 5-(tributylstannyl)-1,2-oxazole-3-carboxylate?
The molecular weight of Ethyl 5-(tributylstannyl)-1,2-oxazole-3-carboxylate is 431.15 g/mol.
Where can I buy Ethyl 5-(tributylstannyl)-1,2-oxazole-3-carboxylate?
You can request a quote for Ethyl 5-(tributylstannyl)-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 5-(tributylstannyl)-1,2-oxazole-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 5-(tributylstannyl)-1,2-oxazole-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.