Ethyl 3-methyl-5-[(phenoxyacetyl)amino]-1,2-thiazole-4-carboxylate
TL;DR: Ethyl 3-methyl-5-[(phenoxyacetyl)amino]-1,2-thiazole-4-carboxylate (CAS 898136-38-4) is a chemical compound with molecular formula C15H16N2O4S and molecular weight 320.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-methyl-5-[(2-phenoxyacetyl)amino]-1,2-thiazole-4-carboxylate
Also Known As: ethyl 3-methyl-5-(2-phenoxyacetamido)isothiazole-4-carboxylate, ethyl 3-methyl-5-[(phenoxyacetyl)amino]-1,2-thiazole-4-carboxylate, ethyl 3-methyl-5-[(2-phenoxyacetyl)amino]-1,2-thiazole-4-carboxylate, ETHYL 3-METHYL-5-[(2-PHENOXYACETYL)AMINO]-4-ISOTHIAZOLECARBOXYLATE
| Molecular Formula | C15H16N2O4S |
|---|---|
| Molecular Weight | 320.08 g/mol |
| LogP | 2.64572 |
| Topological Polar Surface Area | 77.52 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 320.08307 |
| Heavy Atoms | 22 |
| Complexity | 654.817 |
Chemical Identifiers
| CAS Number | 898136-38-4 |
|---|---|
| SMILES | CCOC(=O)C1=C(SN=C1C)NC(=O)COC2=CC=CC=C2 |
Product Overview
Ethyl 3-methyl-5-[(phenoxyacetyl)amino]-1,2-thiazole-4-carboxylate (CAS 898136-38-4), with molecular formula C15H16N2O4S and molecular weight 320.08 g/mol. IUPAC: ethyl 3-methyl-5-[(2-phenoxyacetyl)amino]-1,2-thiazole-4-carboxylate.
Chemical Property Profile of Ethyl 3-methyl-5-[(phenoxyacetyl)amino]-1,2-thiazole-4-carboxylate
Property Insights of Ethyl 3-methyl-5-[(phenoxyacetyl)amino]-1,2-thiazole-4-carboxylate
The XLogP value of 2.64572 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 3-methyl-5-[(phenoxyacetyl)amino]-1,2-thiazole-4-carboxylate. The TPSA of 77.52 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 3-methyl-5-[(phenoxyacetyl)amino]-1,2-thiazole-4-carboxylate. Following Lipinski's Rule of Five, Ethyl 3-methyl-5-[(phenoxyacetyl)amino]-1,2-thiazole-4-carboxylate 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 3-methyl-5-[(phenoxyacetyl)amino]-1,2-thiazole-4-carboxylate?
The CAS number of Ethyl 3-methyl-5-[(phenoxyacetyl)amino]-1,2-thiazole-4-carboxylate is 898136-38-4.
What is the molecular formula of Ethyl 3-methyl-5-[(phenoxyacetyl)amino]-1,2-thiazole-4-carboxylate?
The molecular formula of Ethyl 3-methyl-5-[(phenoxyacetyl)amino]-1,2-thiazole-4-carboxylate is C15H16N2O4S.
What is the molecular weight of Ethyl 3-methyl-5-[(phenoxyacetyl)amino]-1,2-thiazole-4-carboxylate?
The molecular weight of Ethyl 3-methyl-5-[(phenoxyacetyl)amino]-1,2-thiazole-4-carboxylate is 320.08 g/mol.
Where can I buy Ethyl 3-methyl-5-[(phenoxyacetyl)amino]-1,2-thiazole-4-carboxylate?
You can request a quote for Ethyl 3-methyl-5-[(phenoxyacetyl)amino]-1,2-thiazole-4-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 3-methyl-5-[(phenoxyacetyl)amino]-1,2-thiazole-4-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 3-methyl-5-[(phenoxyacetyl)amino]-1,2-thiazole-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.