Methyl 2-(2-dimethylaminoethenyl)-6-oxo-5-[[3-(trifluoromethyl)benzoyl]amino]pyran-3-carboxylate
TL;DR: Methyl 2-(2-dimethylaminoethenyl)-6-oxo-5-[[3-(trifluoromethyl)benzoyl]amino]pyran-3-carboxylate (CAS 341966-20-9) is a chemical compound with molecular formula C19H17F3N2O5 and molecular weight 410.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[2-(dimethylamino)ethenyl]-6-oxo-5-[[3-(trifluoromethyl)benzoyl]amino]pyran-3-carboxylate
Also Known As: Methyl 2-(2-dimethylaminoethenyl)-6-oxo-5-[[3-(trifluoromethyl)benzoyl]amino]pyran-3-carboxylate, methyl 2-[2-(dimethylamino)ethenyl]-6-oxo-5-[[3-(trifluoromethyl)benzoyl]amino]pyran-3-carboxylate, methyl 6-[(E)-2-(dimethylamino)ethenyl]-2-oxo-3-{[3-(trifluoromethyl)benzoyl]amino}-2H-pyran-5-carboxylate
| Molecular Formula | C19H17F3N2O5 |
|---|---|
| Molecular Weight | 410.11 g/mol |
| LogP | 3.2298 |
| Topological Polar Surface Area | 88.85 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 410.10895 |
| Heavy Atoms | 29 |
| Complexity | 1009.6347 |
Chemical Identifiers
| CAS Number | 341966-20-9 |
|---|---|
| SMILES | CN(C)C=CC1=C(C=C(C(=O)O1)NC(=O)C2=CC(=CC=C2)C(F)(F)F)C(=O)OC |
Product Overview
Methyl 2-(2-dimethylaminoethenyl)-6-oxo-5-[[3-(trifluoromethyl)benzoyl]amino]pyran-3-carboxylate (CAS 341966-20-9), with molecular formula C19H17F3N2O5 and molecular weight 410.11 g/mol. IUPAC: methyl 2-[2-(dimethylamino)ethenyl]-6-oxo-5-[[3-(trifluoromethyl)benzoyl]amino]pyran-3-carboxylate.
Chemical Property Profile of Methyl 2-(2-dimethylaminoethenyl)-6-oxo-5-[[3-(trifluoromethyl)benzoyl]amino]pyran-3-carboxylate
Property Insights of Methyl 2-(2-dimethylaminoethenyl)-6-oxo-5-[[3-(trifluoromethyl)benzoyl]amino]pyran-3-carboxylate
The XLogP value of 3.2298 indicates that Methyl 2-(2-dimethylaminoethenyl)-6-oxo-5-[[3-(trifluoromethyl)benzoyl]amino]pyran-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.85 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-(2-dimethylaminoethenyl)-6-oxo-5-[[3-(trifluoromethyl)benzoyl]amino]pyran-3-carboxylate. Following Lipinski's Rule of Five, Methyl 2-(2-dimethylaminoethenyl)-6-oxo-5-[[3-(trifluoromethyl)benzoyl]amino]pyran-3-carboxylate 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 Methyl 2-(2-dimethylaminoethenyl)-6-oxo-5-[[3-(trifluoromethyl)benzoyl]amino]pyran-3-carboxylate?
The CAS number of Methyl 2-(2-dimethylaminoethenyl)-6-oxo-5-[[3-(trifluoromethyl)benzoyl]amino]pyran-3-carboxylate is 341966-20-9.
What is the molecular formula of Methyl 2-(2-dimethylaminoethenyl)-6-oxo-5-[[3-(trifluoromethyl)benzoyl]amino]pyran-3-carboxylate?
The molecular formula of Methyl 2-(2-dimethylaminoethenyl)-6-oxo-5-[[3-(trifluoromethyl)benzoyl]amino]pyran-3-carboxylate is C19H17F3N2O5.
What is the molecular weight of Methyl 2-(2-dimethylaminoethenyl)-6-oxo-5-[[3-(trifluoromethyl)benzoyl]amino]pyran-3-carboxylate?
The molecular weight of Methyl 2-(2-dimethylaminoethenyl)-6-oxo-5-[[3-(trifluoromethyl)benzoyl]amino]pyran-3-carboxylate is 410.11 g/mol.
Where can I buy Methyl 2-(2-dimethylaminoethenyl)-6-oxo-5-[[3-(trifluoromethyl)benzoyl]amino]pyran-3-carboxylate?
You can request a quote for Methyl 2-(2-dimethylaminoethenyl)-6-oxo-5-[[3-(trifluoromethyl)benzoyl]amino]pyran-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-(2-dimethylaminoethenyl)-6-oxo-5-[[3-(trifluoromethyl)benzoyl]amino]pyran-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-(2-dimethylaminoethenyl)-6-oxo-5-[[3-(trifluoromethyl)benzoyl]amino]pyran-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.