Ethyl 2-(2-benzamidoethyl)-1,3-thiazole-4-carboxylate
TL;DR: Ethyl 2-(2-benzamidoethyl)-1,3-thiazole-4-carboxylate (CAS 30979-08-9) is a chemical compound with molecular formula C15H16N2O3S and molecular weight 304.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(2-benzamidoethyl)-1,3-thiazole-4-carboxylate
Also Known As: ethyl 2-(2-benzamidoethyl)-1,3-thiazole-4-carboxylate, 4-Thiazolecarboxylicacid, 2-[2-(benzoylamino)ethyl]-, ethyl ester, ethyl 2-[2-(benzoylamino)ethyl]-1,3-thiazole-4-carboxylate, 2,3,6,7-Tetrahydro-5H-thiazolo<2,3-b><1,3>thiazinium
| Molecular Formula | C15H16N2O3S |
|---|---|
| Molecular Weight | 304.09 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 96.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 304.08817 |
| Heavy Atoms | 21 |
| Complexity | 359.0 |
Chemical Identifiers
| CAS Number | 30979-08-9 |
|---|---|
| SMILES | CCOC(=O)C1=CSC(=N1)CCNC(=O)C2=CC=CC=C2 |
| InChIKey | KPCFTYLQQPYXOM-UHFFFAOYSA-N |
Product Overview
Ethyl 2-(2-benzamidoethyl)-1,3-thiazole-4-carboxylate (CAS 30979-08-9), with molecular formula C15H16N2O3S and molecular weight 304.09 g/mol. IUPAC: ethyl 2-(2-benzamidoethyl)-1,3-thiazole-4-carboxylate.
Chemical Property Profile of Ethyl 2-(2-benzamidoethyl)-1,3-thiazole-4-carboxylate
Property Insights of Ethyl 2-(2-benzamidoethyl)-1,3-thiazole-4-carboxylate
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-(2-benzamidoethyl)-1,3-thiazole-4-carboxylate. The TPSA of 96.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-(2-benzamidoethyl)-1,3-thiazole-4-carboxylate. Following Lipinski's Rule of Five, Ethyl 2-(2-benzamidoethyl)-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-benzamidoethyl)-1,3-thiazole-4-carboxylate?
The CAS number of Ethyl 2-(2-benzamidoethyl)-1,3-thiazole-4-carboxylate is 30979-08-9.
What is the molecular formula of Ethyl 2-(2-benzamidoethyl)-1,3-thiazole-4-carboxylate?
The molecular formula of Ethyl 2-(2-benzamidoethyl)-1,3-thiazole-4-carboxylate is C15H16N2O3S.
What is the molecular weight of Ethyl 2-(2-benzamidoethyl)-1,3-thiazole-4-carboxylate?
The molecular weight of Ethyl 2-(2-benzamidoethyl)-1,3-thiazole-4-carboxylate is 304.09 g/mol.
Where can I buy Ethyl 2-(2-benzamidoethyl)-1,3-thiazole-4-carboxylate?
You can request a quote for Ethyl 2-(2-benzamidoethyl)-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-benzamidoethyl)-1,3-thiazole-4-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-(2-benzamidoethyl)-1,3-thiazole-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.