![ethyl 2-[[tert-butyl-(2-chloro-2-phenylacetyl)amino]methyl]-1,3-thiazole-4-carboxylate structure](/static/products/5945/5945-67-5.webp)
ethyl 2-[[tert-butyl-(2-chloro-2-phenylacetyl)amino]methyl]-1,3-thiazole-4-carboxylate
TL;DR: ethyl 2-[[tert-butyl-(2-chloro-2-phenylacetyl)amino]methyl]-1,3-thiazole-4-carboxylate (CAS 5945-67-5) is a chemical compound with molecular formula C19H23ClN2O3S and molecular weight 394.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[tert-butyl-(2-chloro-2-phenylacetyl)amino]methyl]-1,3-thiazole-4-carboxylate
Also Known As: ethyl 2-[[tert-butyl-(2-chloro-2-phenylacetyl)amino]methyl]-1,3-thiazole-4-carboxylate, Ethyl 2-[(N-tert-butyl-2-chloro-2-phenylacetamido)methyl]-1,3-thiazole-4-carboxylate
| Molecular Formula | C19H23ClN2O3S |
|---|---|
| Molecular Weight | 394.11 g/mol |
| LogP | 4.427 |
| Topological Polar Surface Area | 59.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 394.1118 |
| Heavy Atoms | 26 |
| Complexity | 755.6448 |
Chemical Identifiers
| CAS Number | 5945-67-5 |
|---|---|
| SMILES | CCOC(=O)C1=CSC(=N1)CN(C(=O)C(C2=CC=CC=C2)Cl)C(C)(C)C |
Product Overview
ethyl 2-[[tert-butyl-(2-chloro-2-phenylacetyl)amino]methyl]-1,3-thiazole-4-carboxylate (CAS 5945-67-5), with molecular formula C19H23ClN2O3S and molecular weight 394.11 g/mol. IUPAC: ethyl 2-[[tert-butyl-(2-chloro-2-phenylacetyl)amino]methyl]-1,3-thiazole-4-carboxylate.
Chemical Property Profile of ethyl 2-[[tert-butyl-(2-chloro-2-phenylacetyl)amino]methyl]-1,3-thiazole-4-carboxylate
Property Insights of ethyl 2-[[tert-butyl-(2-chloro-2-phenylacetyl)amino]methyl]-1,3-thiazole-4-carboxylate
The XLogP value of 4.427 indicates that ethyl 2-[[tert-butyl-(2-chloro-2-phenylacetyl)amino]methyl]-1,3-thiazole-4-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.5 Ų, ethyl 2-[[tert-butyl-(2-chloro-2-phenylacetyl)amino]methyl]-1,3-thiazole-4-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ethyl 2-[[tert-butyl-(2-chloro-2-phenylacetyl)amino]methyl]-1,3-thiazole-4-carboxylate has 0 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-[[tert-butyl-(2-chloro-2-phenylacetyl)amino]methyl]-1,3-thiazole-4-carboxylate?
The CAS number of ethyl 2-[[tert-butyl-(2-chloro-2-phenylacetyl)amino]methyl]-1,3-thiazole-4-carboxylate is 5945-67-5.
What is the molecular formula of ethyl 2-[[tert-butyl-(2-chloro-2-phenylacetyl)amino]methyl]-1,3-thiazole-4-carboxylate?
The molecular formula of ethyl 2-[[tert-butyl-(2-chloro-2-phenylacetyl)amino]methyl]-1,3-thiazole-4-carboxylate is C19H23ClN2O3S.
What is the molecular weight of ethyl 2-[[tert-butyl-(2-chloro-2-phenylacetyl)amino]methyl]-1,3-thiazole-4-carboxylate?
The molecular weight of ethyl 2-[[tert-butyl-(2-chloro-2-phenylacetyl)amino]methyl]-1,3-thiazole-4-carboxylate is 394.11 g/mol.
Where can I buy ethyl 2-[[tert-butyl-(2-chloro-2-phenylacetyl)amino]methyl]-1,3-thiazole-4-carboxylate?
You can request a quote for ethyl 2-[[tert-butyl-(2-chloro-2-phenylacetyl)amino]methyl]-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-[[tert-butyl-(2-chloro-2-phenylacetyl)amino]methyl]-1,3-thiazole-4-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 2-[[tert-butyl-(2-chloro-2-phenylacetyl)amino]methyl]-1,3-thiazole-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.