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Ethyl {2-[(4-phenoxybutanoyl)amino]-1,3-thiazol-4-yl}acetate
TL;DR: Ethyl {2-[(4-phenoxybutanoyl)amino]-1,3-thiazol-4-yl}acetate (CAS 460045-36-7) is a chemical compound with molecular formula C17H20N2O4S and molecular weight 348.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[2-(4-phenoxybutanoylamino)-1,3-thiazol-4-yl]acetate
Also Known As: BAS 03590759, ethyl 2-(2-(4-phenoxybutanamido)thiazol-4-yl)acetate, ethyl {2-[(4-phenoxybutanoyl)amino]-1,3-thiazol-4-yl}acetate, ethyl 2-[2-(4-phenoxybutanoylamino)-1,3-thiazol-4-yl]acetate, [2-(4-Phenoxy-butyrylamino)-thiazol-4-yl]-acetic acid ethyl ester
| Molecular Formula | C17H20N2O4S |
|---|---|
| Molecular Weight | 348.11 g/mol |
| LogP | 3.0464 |
| Topological Polar Surface Area | 77.52 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 348.11438 |
| Heavy Atoms | 24 |
| Complexity | 657.62 |
Chemical Identifiers
| CAS Number | 460045-36-7 |
|---|---|
| SMILES | CCOC(=O)CC1=CSC(=N1)NC(=O)CCCOC2=CC=CC=C2 |
Product Overview
Ethyl {2-[(4-phenoxybutanoyl)amino]-1,3-thiazol-4-yl}acetate (CAS 460045-36-7), with molecular formula C17H20N2O4S and molecular weight 348.11 g/mol. IUPAC: ethyl 2-[2-(4-phenoxybutanoylamino)-1,3-thiazol-4-yl]acetate.
Chemical Property Profile of Ethyl {2-[(4-phenoxybutanoyl)amino]-1,3-thiazol-4-yl}acetate
Property Insights of Ethyl {2-[(4-phenoxybutanoyl)amino]-1,3-thiazol-4-yl}acetate
The XLogP value of 3.0464 indicates that Ethyl {2-[(4-phenoxybutanoyl)amino]-1,3-thiazol-4-yl}acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.52 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl {2-[(4-phenoxybutanoyl)amino]-1,3-thiazol-4-yl}acetate. Following Lipinski's Rule of Five, Ethyl {2-[(4-phenoxybutanoyl)amino]-1,3-thiazol-4-yl}acetate 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 Ethyl {2-[(4-phenoxybutanoyl)amino]-1,3-thiazol-4-yl}acetate?
The CAS number of Ethyl {2-[(4-phenoxybutanoyl)amino]-1,3-thiazol-4-yl}acetate is 460045-36-7.
What is the molecular formula of Ethyl {2-[(4-phenoxybutanoyl)amino]-1,3-thiazol-4-yl}acetate?
The molecular formula of Ethyl {2-[(4-phenoxybutanoyl)amino]-1,3-thiazol-4-yl}acetate is C17H20N2O4S.
What is the molecular weight of Ethyl {2-[(4-phenoxybutanoyl)amino]-1,3-thiazol-4-yl}acetate?
The molecular weight of Ethyl {2-[(4-phenoxybutanoyl)amino]-1,3-thiazol-4-yl}acetate is 348.11 g/mol.
Where can I buy Ethyl {2-[(4-phenoxybutanoyl)amino]-1,3-thiazol-4-yl}acetate?
You can request a quote for Ethyl {2-[(4-phenoxybutanoyl)amino]-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-[(4-phenoxybutanoyl)amino]-1,3-thiazol-4-yl}acetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl {2-[(4-phenoxybutanoyl)amino]-1,3-thiazol-4-yl}acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.