![ethyl 3,3,3-trifluoro-2-methoxy-2-({[(5-methyl-4,5-dihydro-1,3-thiazol-2-yl)anilino]carbonyl}amino)propanoate structure](/static/products/312/312286-99-0.png)
ethyl 3,3,3-trifluoro-2-methoxy-2-({[(5-methyl-4,5-dihydro-1,3-thiazol-2-yl)anilino]carbonyl}amino)propanoate
TL;DR: ethyl 3,3,3-trifluoro-2-methoxy-2-({[(5-methyl-4,5-dihydro-1,3-thiazol-2-yl)anilino]carbonyl}amino)propanoate (CAS 312286-99-0) is a chemical compound with molecular formula C17H20F3N3O4S and molecular weight 419.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3,3,3-trifluoro-2-methoxy-2-[[(5-methyl-4,5-dihydro-1,3-thiazol-2-yl)-phenylcarbamoyl]amino]propanoate
Also Known As: ethyl 3,3,3-trifluoro-2-methoxy-2-({[(5-methyl-4,5-dihydro-1,3-thiazol-2-yl)anilino]carbonyl}amino)propanoate, ethyl 3,3,3-trifluoro-2-methoxy-2-(3-(5-methyl-4,5-dihydrothiazol-2-yl)-3-phenylureido)propanoate, ethyl 3,3,3-trifluoro-2-methoxy-2-[[(5-methyl-4,5-dihydro-1,3-thiazol-2-yl)-phenylcarbamoyl]amino]propanoate, ethyl 3,3,3-trifluoro-2-methoxy-N-[(5-methyl-4,5-dihydro-1,3-thiazol-2-yl)(phenyl)carbamoyl]alaninate
| Molecular Formula | C17H20F3N3O4S |
|---|---|
| Molecular Weight | 419.11 g/mol |
| LogP | 3.162 |
| Topological Polar Surface Area | 80.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 419.11267 |
| Heavy Atoms | 28 |
| Complexity | 744.9132 |
Chemical Identifiers
| CAS Number | 312286-99-0 |
|---|---|
| SMILES | CCOC(=O)C(C(F)(F)F)(NC(=O)N(C1=CC=CC=C1)C2=NCC(S2)C)OC |
Product Overview
ethyl 3,3,3-trifluoro-2-methoxy-2-({[(5-methyl-4,5-dihydro-1,3-thiazol-2-yl)anilino]carbonyl}amino)propanoate (CAS 312286-99-0), with molecular formula C17H20F3N3O4S and molecular weight 419.11 g/mol. IUPAC: ethyl 3,3,3-trifluoro-2-methoxy-2-[[(5-methyl-4,5-dihydro-1,3-thiazol-2-yl)-phenylcarbamoyl]amino]propanoate.
Chemical Property Profile of ethyl 3,3,3-trifluoro-2-methoxy-2-({[(5-methyl-4,5-dihydro-1,3-thiazol-2-yl)anilino]carbonyl}amino)propanoate
Property Insights of ethyl 3,3,3-trifluoro-2-methoxy-2-({[(5-methyl-4,5-dihydro-1,3-thiazol-2-yl)anilino]carbonyl}amino)propanoate
The XLogP value of 3.162 indicates that ethyl 3,3,3-trifluoro-2-methoxy-2-({[(5-methyl-4,5-dihydro-1,3-thiazol-2-yl)anilino]carbonyl}amino)propanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.23 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 3,3,3-trifluoro-2-methoxy-2-({[(5-methyl-4,5-dihydro-1,3-thiazol-2-yl)anilino]carbonyl}amino)propanoate. Following Lipinski's Rule of Five, ethyl 3,3,3-trifluoro-2-methoxy-2-({[(5-methyl-4,5-dihydro-1,3-thiazol-2-yl)anilino]carbonyl}amino)propanoate has 1 hydrogen bond donor(s) and 6 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 3,3,3-trifluoro-2-methoxy-2-({[(5-methyl-4,5-dihydro-1,3-thiazol-2-yl)anilino]carbonyl}amino)propanoate?
The CAS number of ethyl 3,3,3-trifluoro-2-methoxy-2-({[(5-methyl-4,5-dihydro-1,3-thiazol-2-yl)anilino]carbonyl}amino)propanoate is 312286-99-0.
What is the molecular formula of ethyl 3,3,3-trifluoro-2-methoxy-2-({[(5-methyl-4,5-dihydro-1,3-thiazol-2-yl)anilino]carbonyl}amino)propanoate?
The molecular formula of ethyl 3,3,3-trifluoro-2-methoxy-2-({[(5-methyl-4,5-dihydro-1,3-thiazol-2-yl)anilino]carbonyl}amino)propanoate is C17H20F3N3O4S.
What is the molecular weight of ethyl 3,3,3-trifluoro-2-methoxy-2-({[(5-methyl-4,5-dihydro-1,3-thiazol-2-yl)anilino]carbonyl}amino)propanoate?
The molecular weight of ethyl 3,3,3-trifluoro-2-methoxy-2-({[(5-methyl-4,5-dihydro-1,3-thiazol-2-yl)anilino]carbonyl}amino)propanoate is 419.11 g/mol.
Where can I buy ethyl 3,3,3-trifluoro-2-methoxy-2-({[(5-methyl-4,5-dihydro-1,3-thiazol-2-yl)anilino]carbonyl}amino)propanoate?
You can request a quote for ethyl 3,3,3-trifluoro-2-methoxy-2-({[(5-methyl-4,5-dihydro-1,3-thiazol-2-yl)anilino]carbonyl}amino)propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 3,3,3-trifluoro-2-methoxy-2-({[(5-methyl-4,5-dihydro-1,3-thiazol-2-yl)anilino]carbonyl}amino)propanoate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 3,3,3-trifluoro-2-methoxy-2-({[(5-methyl-4,5-dihydro-1,3-thiazol-2-yl)anilino]carbonyl}amino)propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.