Ethyl 2-benzamido-1,3-thiazole-4-carboxylate
TL;DR: Ethyl 2-benzamido-1,3-thiazole-4-carboxylate (CAS 126612-88-2) is a chemical compound with molecular formula C13H12N2O3S and molecular weight 276.05685 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 2-benzamido-1,3-thiazole-4-carboxylate
Also Known As: IFLab1_000250, ethyl 2-benzamido-1,3-thiazole-4-carboxylate, ethyl 2-benzamidothiazole-4-carboxylate, IDI1_008469, Ethyl 2-(benzoylamino)-4-thiazolecarboxylate
Technical Specifications
| Molecular Formula | C13H12N2O3S |
| Molecular Weight | 276.05685 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 96.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 276.05685 Da |
| Heavy Atoms | 19 |
| Complexity | 332.0 |
| SMILES | CCOC(=O)C1=CSC(=N1)NC(=O)C2=CC=CC=C2 |
| InChIKey | APARLFOMPOBXSE-UHFFFAOYSA-N |
Chemical Property Profile of Ethyl 2-benzamido-1,3-thiazole-4-carboxylate
Property Insights of Ethyl 2-benzamido-1,3-thiazole-4-carboxylate
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-benzamido-1,3-thiazole-4-carboxylate. The TPSA of 96.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-benzamido-1,3-thiazole-4-carboxylate. Following Lipinski's Rule of Five, Ethyl 2-benzamido-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
What is the CAS number of Ethyl 2-benzamido-1,3-thiazole-4-carboxylate?
The CAS number of Ethyl 2-benzamido-1,3-thiazole-4-carboxylate is 126612-88-2.
What is the molecular formula of Ethyl 2-benzamido-1,3-thiazole-4-carboxylate?
The molecular formula of Ethyl 2-benzamido-1,3-thiazole-4-carboxylate is C13H12N2O3S.
What is the molecular weight of Ethyl 2-benzamido-1,3-thiazole-4-carboxylate?
The molecular weight of Ethyl 2-benzamido-1,3-thiazole-4-carboxylate is 276.05685 g/mol.
Where can I buy Ethyl 2-benzamido-1,3-thiazole-4-carboxylate?
You can request a quote for Ethyl 2-benzamido-1,3-thiazole-4-carboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ethyl 2-benzamido-1,3-thiazole-4-carboxylate?
Yes, CoreyChem provides custom synthesis services for Ethyl 2-benzamido-1,3-thiazole-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.