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Ethyl 2-[(2-chloroacetyl)amino]-1,3-thiazole-4-carboxylate
TL;DR: Ethyl 2-[(2-chloroacetyl)amino]-1,3-thiazole-4-carboxylate (CAS 19745-93-8) is a chemical compound with molecular formula C8H9ClN2O3S and molecular weight 248.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[(2-chloroacetyl)amino]-1,3-thiazole-4-carboxylate
Also Known As: ethyl 2-[(2-chloroacetyl)amino]-1,3-thiazole-4-carboxylate, ethyl 2-(2-chloroacetamido)-1,3-thiazole-4-carboxylate, J1.106.296B, Ethyl 2-(2-chloroacetamido)thiazole-4-carboxylate, 2-(Chloroacetylamino)-4-thiazolecarboxylic acid ethyl ester
| Molecular Formula | C8H9ClN2O3S |
|---|---|
| Molecular Weight | 248.00 g/mol |
| LogP | 1.4971 |
| Topological Polar Surface Area | 68.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 248.00224 |
| Heavy Atoms | 15 |
| Complexity | 366.52368 |
Chemical Identifiers
| CAS Number | 19745-93-8 |
|---|---|
| SMILES | CCOC(=O)C1=CSC(=N1)NC(=O)CCl |
Product Overview
Ethyl 2-[(2-chloroacetyl)amino]-1,3-thiazole-4-carboxylate (CAS 19745-93-8), with molecular formula C8H9ClN2O3S and molecular weight 248.00 g/mol. IUPAC: ethyl 2-[(2-chloroacetyl)amino]-1,3-thiazole-4-carboxylate.
Chemical Property Profile of Ethyl 2-[(2-chloroacetyl)amino]-1,3-thiazole-4-carboxylate
Property Insights of Ethyl 2-[(2-chloroacetyl)amino]-1,3-thiazole-4-carboxylate
The XLogP value of 1.4971 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-[(2-chloroacetyl)amino]-1,3-thiazole-4-carboxylate. The TPSA of 68.29 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-[(2-chloroacetyl)amino]-1,3-thiazole-4-carboxylate. Following Lipinski's Rule of Five, Ethyl 2-[(2-chloroacetyl)amino]-1,3-thiazole-4-carboxylate 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-[(2-chloroacetyl)amino]-1,3-thiazole-4-carboxylate?
The CAS number of Ethyl 2-[(2-chloroacetyl)amino]-1,3-thiazole-4-carboxylate is 19745-93-8.
What is the molecular formula of Ethyl 2-[(2-chloroacetyl)amino]-1,3-thiazole-4-carboxylate?
The molecular formula of Ethyl 2-[(2-chloroacetyl)amino]-1,3-thiazole-4-carboxylate is C8H9ClN2O3S.
What is the molecular weight of Ethyl 2-[(2-chloroacetyl)amino]-1,3-thiazole-4-carboxylate?
The molecular weight of Ethyl 2-[(2-chloroacetyl)amino]-1,3-thiazole-4-carboxylate is 248.00 g/mol.
Where can I buy Ethyl 2-[(2-chloroacetyl)amino]-1,3-thiazole-4-carboxylate?
You can request a quote for Ethyl 2-[(2-chloroacetyl)amino]-1,3-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 2-[(2-chloroacetyl)amino]-1,3-thiazole-4-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-[(2-chloroacetyl)amino]-1,3-thiazole-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.