(Z)-ethyl 3-(2-methoxyphenyl)-4-methyl-2-(1,1,1-trifluoro-3-methoxy-3-oxopropan-2-ylidene)-2,3-dihydrothiazole-5-carboxylate
TL;DR: (Z)-ethyl 3-(2-methoxyphenyl)-4-methyl-2-(1,1,1-trifluoro-3-methoxy-3-oxopropan-2-ylidene)-2,3-dihydrothiazole-5-carboxylate (CAS 428873-94-3) is a chemical compound with molecular formula C18H18F3NO5S and molecular weight 417.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (2Z)-3-(2-methoxyphenyl)-4-methyl-2-(1,1,1-trifluoro-3-methoxy-3-oxopropan-2-ylidene)-1,3-thiazole-5-carboxylate
Also Known As: (Z)-ethyl 3-(2-methoxyphenyl)-4-methyl-2-(1,1,1-trifluoro-3-methoxy-3-oxopropan-2-ylidene)-2,3-dihydrothiazole-5-carboxylate, 3-(2-Methoxy-phenyl)-4-methyl-2-(2,2,2-trifluoro-1-methoxycarbonyl-ethylidene)-2,3-dihydro-thiazole-5-carboxylic acid ethyl ester, ethyl (2Z)-3-(2-methoxyphenyl)-4-methyl-2-(1,1,1-trifluoro-3-methoxy-3-oxopropan-2-ylidene)-1,3-thiazole-5-carboxylate, ethyl (2Z)-3-(2-methoxyphenyl)-4-methyl-2-(1,1,1-trifluoro-3-methoxy-3-oxopropan-2-ylidene)-2,3-dihydro-1,3-thiazole-5-carboxylate, Ethyl (2Z)-3-(2-methoxyphenyl)-4-methyl-2-[2,2,2-trifluoro-1-(methoxycarbonyl)ethylidene]-2,3-dihydro-1,3-thiazole-5-carboxylate #
| Molecular Formula | C18H18F3NO5S |
|---|---|
| Molecular Weight | 417.09 g/mol |
| LogP | 3.9899 |
| Topological Polar Surface Area | 65.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 417.0858 |
| Heavy Atoms | 28 |
| Complexity | 847.868 |
Chemical Identifiers
| CAS Number | 428873-94-3 |
|---|---|
| SMILES | CCOC(=O)C1=C(N(/C(=C(\C(=O)OC)/C(F)(F)F)/S1)C2=CC=CC=C2OC)C |
Product Overview
(Z)-ethyl 3-(2-methoxyphenyl)-4-methyl-2-(1,1,1-trifluoro-3-methoxy-3-oxopropan-2-ylidene)-2,3-dihydrothiazole-5-carboxylate (CAS 428873-94-3), with molecular formula C18H18F3NO5S and molecular weight 417.09 g/mol. IUPAC: ethyl (2Z)-3-(2-methoxyphenyl)-4-methyl-2-(1,1,1-trifluoro-3-methoxy-3-oxopropan-2-ylidene)-1,3-thiazole-5-carboxylate.
Chemical Property Profile of (Z)-ethyl 3-(2-methoxyphenyl)-4-methyl-2-(1,1,1-trifluoro-3-methoxy-3-oxopropan-2-ylidene)-2,3-dihydrothiazole-5-carboxylate
Property Insights of (Z)-ethyl 3-(2-methoxyphenyl)-4-methyl-2-(1,1,1-trifluoro-3-methoxy-3-oxopropan-2-ylidene)-2,3-dihydrothiazole-5-carboxylate
The XLogP value of 3.9899 indicates that (Z)-ethyl 3-(2-methoxyphenyl)-4-methyl-2-(1,1,1-trifluoro-3-methoxy-3-oxopropan-2-ylidene)-2,3-dihydrothiazole-5-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.07 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-ethyl 3-(2-methoxyphenyl)-4-methyl-2-(1,1,1-trifluoro-3-methoxy-3-oxopropan-2-ylidene)-2,3-dihydrothiazole-5-carboxylate. Following Lipinski's Rule of Five, (Z)-ethyl 3-(2-methoxyphenyl)-4-methyl-2-(1,1,1-trifluoro-3-methoxy-3-oxopropan-2-ylidene)-2,3-dihydrothiazole-5-carboxylate has 0 hydrogen bond donor(s) and 7 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 (Z)-ethyl 3-(2-methoxyphenyl)-4-methyl-2-(1,1,1-trifluoro-3-methoxy-3-oxopropan-2-ylidene)-2,3-dihydrothiazole-5-carboxylate?
The CAS number of (Z)-ethyl 3-(2-methoxyphenyl)-4-methyl-2-(1,1,1-trifluoro-3-methoxy-3-oxopropan-2-ylidene)-2,3-dihydrothiazole-5-carboxylate is 428873-94-3.
What is the molecular formula of (Z)-ethyl 3-(2-methoxyphenyl)-4-methyl-2-(1,1,1-trifluoro-3-methoxy-3-oxopropan-2-ylidene)-2,3-dihydrothiazole-5-carboxylate?
The molecular formula of (Z)-ethyl 3-(2-methoxyphenyl)-4-methyl-2-(1,1,1-trifluoro-3-methoxy-3-oxopropan-2-ylidene)-2,3-dihydrothiazole-5-carboxylate is C18H18F3NO5S.
What is the molecular weight of (Z)-ethyl 3-(2-methoxyphenyl)-4-methyl-2-(1,1,1-trifluoro-3-methoxy-3-oxopropan-2-ylidene)-2,3-dihydrothiazole-5-carboxylate?
The molecular weight of (Z)-ethyl 3-(2-methoxyphenyl)-4-methyl-2-(1,1,1-trifluoro-3-methoxy-3-oxopropan-2-ylidene)-2,3-dihydrothiazole-5-carboxylate is 417.09 g/mol.
Where can I buy (Z)-ethyl 3-(2-methoxyphenyl)-4-methyl-2-(1,1,1-trifluoro-3-methoxy-3-oxopropan-2-ylidene)-2,3-dihydrothiazole-5-carboxylate?
You can request a quote for (Z)-ethyl 3-(2-methoxyphenyl)-4-methyl-2-(1,1,1-trifluoro-3-methoxy-3-oxopropan-2-ylidene)-2,3-dihydrothiazole-5-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-ethyl 3-(2-methoxyphenyl)-4-methyl-2-(1,1,1-trifluoro-3-methoxy-3-oxopropan-2-ylidene)-2,3-dihydrothiazole-5-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for (Z)-ethyl 3-(2-methoxyphenyl)-4-methyl-2-(1,1,1-trifluoro-3-methoxy-3-oxopropan-2-ylidene)-2,3-dihydrothiazole-5-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.