Ethyl 2-amino-4-phenyl-1,3-thiazole-5-carboxylate
TL;DR: Ethyl 2-amino-4-phenyl-1,3-thiazole-5-carboxylate (CAS 64399-23-1) is a chemical compound with molecular formula C12H12N2O2S and molecular weight 248.06195 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 2-amino-4-phenyl-1,3-thiazole-5-carboxylate
Also Known As: Ethyl 2-amino-4-phenylthiazole-5-carboxylate, ethyl 2-amino-4-phenyl-1,3-thiazole-5-carboxylate, null, Ethyl 2-amino-4-phenyl-5-thiazolecarboxylate, IFLab1_000326
Application Areas
Top 5 of 4 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C12H12N2O2S |
| Molecular Weight | 248.06195 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 93.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 248.06195 Da |
| Heavy Atoms | 17 |
| Complexity | 269.0 |
| SMILES | CCOC(=O)C1=C(N=C(S1)N)C2=CC=CC=C2 |
| InChIKey | OZMXFXOHCUEEPD-UHFFFAOYSA-N |
Chemical Property Profile of Ethyl 2-amino-4-phenyl-1,3-thiazole-5-carboxylate
Property Insights of Ethyl 2-amino-4-phenyl-1,3-thiazole-5-carboxylate
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-amino-4-phenyl-1,3-thiazole-5-carboxylate. The TPSA of 93.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-amino-4-phenyl-1,3-thiazole-5-carboxylate. Following Lipinski's Rule of Five, Ethyl 2-amino-4-phenyl-1,3-thiazole-5-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-amino-4-phenyl-1,3-thiazole-5-carboxylate?
The CAS number of Ethyl 2-amino-4-phenyl-1,3-thiazole-5-carboxylate is 64399-23-1.
What is the molecular formula of Ethyl 2-amino-4-phenyl-1,3-thiazole-5-carboxylate?
The molecular formula of Ethyl 2-amino-4-phenyl-1,3-thiazole-5-carboxylate is C12H12N2O2S.
What is the molecular weight of Ethyl 2-amino-4-phenyl-1,3-thiazole-5-carboxylate?
The molecular weight of Ethyl 2-amino-4-phenyl-1,3-thiazole-5-carboxylate is 248.06195 g/mol.
Where can I buy Ethyl 2-amino-4-phenyl-1,3-thiazole-5-carboxylate?
You can request a quote for Ethyl 2-amino-4-phenyl-1,3-thiazole-5-carboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ethyl 2-amino-4-phenyl-1,3-thiazole-5-carboxylate?
Yes, CoreyChem provides custom synthesis services for Ethyl 2-amino-4-phenyl-1,3-thiazole-5-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.