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Ethyl [2-(butanoylamino)-1,3-thiazol-4-yl]acetate
TL;DR: Ethyl [2-(butanoylamino)-1,3-thiazol-4-yl]acetate (CAS 446837-80-5) is a chemical compound with molecular formula C11H16N2O3S and molecular weight 256.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[2-(butanoylamino)-1,3-thiazol-4-yl]acetate
Also Known As: BAS 09533449, ethyl 2-(2-butyramidothiazol-4-yl)acetate, ethyl [2-(butanoylamino)-1,3-thiazol-4-yl]acetate, ethyl 2-[2-(butanoylamino)-1,3-thiazol-4-yl]acetate, ethyl [2-(butyrylamino)-1,3-thiazol-4-yl]acetate
| Molecular Formula | C11H16N2O3S |
|---|---|
| Molecular Weight | 256.09 g/mol |
| LogP | 1.9873 |
| Topological Polar Surface Area | 68.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 256.08817 |
| Heavy Atoms | 17 |
| Complexity | 355.32318 |
Chemical Identifiers
| CAS Number | 446837-80-5 |
|---|---|
| SMILES | CCCC(=O)NC1=NC(=CS1)CC(=O)OCC |
Product Overview
Ethyl [2-(butanoylamino)-1,3-thiazol-4-yl]acetate (CAS 446837-80-5), with molecular formula C11H16N2O3S and molecular weight 256.09 g/mol. IUPAC: ethyl 2-[2-(butanoylamino)-1,3-thiazol-4-yl]acetate.
Chemical Property Profile of Ethyl [2-(butanoylamino)-1,3-thiazol-4-yl]acetate
Property Insights of Ethyl [2-(butanoylamino)-1,3-thiazol-4-yl]acetate
The XLogP value of 1.9873 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl [2-(butanoylamino)-1,3-thiazol-4-yl]acetate. The TPSA of 68.29 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl [2-(butanoylamino)-1,3-thiazol-4-yl]acetate. Following Lipinski's Rule of Five, Ethyl [2-(butanoylamino)-1,3-thiazol-4-yl]acetate has 1 hydrogen bond donor(s) and 5 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 [2-(butanoylamino)-1,3-thiazol-4-yl]acetate?
The CAS number of Ethyl [2-(butanoylamino)-1,3-thiazol-4-yl]acetate is 446837-80-5.
What is the molecular formula of Ethyl [2-(butanoylamino)-1,3-thiazol-4-yl]acetate?
The molecular formula of Ethyl [2-(butanoylamino)-1,3-thiazol-4-yl]acetate is C11H16N2O3S.
What is the molecular weight of Ethyl [2-(butanoylamino)-1,3-thiazol-4-yl]acetate?
The molecular weight of Ethyl [2-(butanoylamino)-1,3-thiazol-4-yl]acetate is 256.09 g/mol.
Where can I buy Ethyl [2-(butanoylamino)-1,3-thiazol-4-yl]acetate?
You can request a quote for Ethyl [2-(butanoylamino)-1,3-thiazol-4-yl]acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl [2-(butanoylamino)-1,3-thiazol-4-yl]acetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl [2-(butanoylamino)-1,3-thiazol-4-yl]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.