![N-{2-[(Z)-(dimethylamino)methylidene]-5-ethoxy-6-methoxy-3-oxo-1,3-dihydro-2H-inden-1-yl}-2,2,2-trifluoroacetamide structure](/static/products/866/866040-50-8.png)
N-{2-[(Z)-(dimethylamino)methylidene]-5-ethoxy-6-methoxy-3-oxo-1,3-dihydro-2H-inden-1-yl}-2,2,2-trifluoroacetamide
TL;DR: N-{2-[(Z)-(dimethylamino)methylidene]-5-ethoxy-6-methoxy-3-oxo-1,3-dihydro-2H-inden-1-yl}-2,2,2-trifluoroacetamide (CAS 866040-50-8) is a chemical compound with molecular formula C17H19F3N2O4 and molecular weight 372.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(dimethylaminomethylidene)-5-ethoxy-6-methoxy-3-oxo-1H-inden-1-yl]-2,2,2-trifluoroacetamide
Also Known As: N-{2-[(Z)-(dimethylamino)methylidene]-5-ethoxy-6-methoxy-3-oxo-1,3-dihydro-2H-inden-1-yl}-2,2,2-trifluoroacetamide, N-[2-(dimethylaminomethylidene)-5-ethoxy-6-methoxy-3-oxo-1H-inden-1-yl]-2,2,2-trifluoroacetamide
| Molecular Formula | C17H19F3N2O4 |
|---|---|
| Molecular Weight | 372.13 g/mol |
| LogP | 2.4553 |
| Topological Polar Surface Area | 67.87 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 372.1297 |
| Heavy Atoms | 26 |
| Complexity | 757.1103 |
Chemical Identifiers
| CAS Number | 866040-50-8 |
|---|---|
| SMILES | CCOC1=C(C=C2C(C(=CN(C)C)C(=O)C2=C1)NC(=O)C(F)(F)F)OC |
Product Overview
N-{2-[(Z)-(dimethylamino)methylidene]-5-ethoxy-6-methoxy-3-oxo-1,3-dihydro-2H-inden-1-yl}-2,2,2-trifluoroacetamide (CAS 866040-50-8), with molecular formula C17H19F3N2O4 and molecular weight 372.13 g/mol. IUPAC: N-[2-(dimethylaminomethylidene)-5-ethoxy-6-methoxy-3-oxo-1H-inden-1-yl]-2,2,2-trifluoroacetamide.
Chemical Property Profile of N-{2-[(Z)-(dimethylamino)methylidene]-5-ethoxy-6-methoxy-3-oxo-1,3-dihydro-2H-inden-1-yl}-2,2,2-trifluoroacetamide
Property Insights of N-{2-[(Z)-(dimethylamino)methylidene]-5-ethoxy-6-methoxy-3-oxo-1,3-dihydro-2H-inden-1-yl}-2,2,2-trifluoroacetamide
The XLogP value of 2.4553 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-{2-[(Z)-(dimethylamino)methylidene]-5-ethoxy-6-methoxy-3-oxo-1,3-dihydro-2H-inden-1-yl}-2,2,2-trifluoroacetamide. The TPSA of 67.87 Ų falls within the moderate polarity range, balancing permeability and solubility for N-{2-[(Z)-(dimethylamino)methylidene]-5-ethoxy-6-methoxy-3-oxo-1,3-dihydro-2H-inden-1-yl}-2,2,2-trifluoroacetamide. Following Lipinski's Rule of Five, N-{2-[(Z)-(dimethylamino)methylidene]-5-ethoxy-6-methoxy-3-oxo-1,3-dihydro-2H-inden-1-yl}-2,2,2-trifluoroacetamide 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
Frequently Asked Questions
What is the CAS number of N-{2-[(Z)-(dimethylamino)methylidene]-5-ethoxy-6-methoxy-3-oxo-1,3-dihydro-2H-inden-1-yl}-2,2,2-trifluoroacetamide?
The CAS number of N-{2-[(Z)-(dimethylamino)methylidene]-5-ethoxy-6-methoxy-3-oxo-1,3-dihydro-2H-inden-1-yl}-2,2,2-trifluoroacetamide is 866040-50-8.
What is the molecular formula of N-{2-[(Z)-(dimethylamino)methylidene]-5-ethoxy-6-methoxy-3-oxo-1,3-dihydro-2H-inden-1-yl}-2,2,2-trifluoroacetamide?
The molecular formula of N-{2-[(Z)-(dimethylamino)methylidene]-5-ethoxy-6-methoxy-3-oxo-1,3-dihydro-2H-inden-1-yl}-2,2,2-trifluoroacetamide is C17H19F3N2O4.
What is the molecular weight of N-{2-[(Z)-(dimethylamino)methylidene]-5-ethoxy-6-methoxy-3-oxo-1,3-dihydro-2H-inden-1-yl}-2,2,2-trifluoroacetamide?
The molecular weight of N-{2-[(Z)-(dimethylamino)methylidene]-5-ethoxy-6-methoxy-3-oxo-1,3-dihydro-2H-inden-1-yl}-2,2,2-trifluoroacetamide is 372.13 g/mol.
Where can I buy N-{2-[(Z)-(dimethylamino)methylidene]-5-ethoxy-6-methoxy-3-oxo-1,3-dihydro-2H-inden-1-yl}-2,2,2-trifluoroacetamide?
You can request a quote for N-{2-[(Z)-(dimethylamino)methylidene]-5-ethoxy-6-methoxy-3-oxo-1,3-dihydro-2H-inden-1-yl}-2,2,2-trifluoroacetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-{2-[(Z)-(dimethylamino)methylidene]-5-ethoxy-6-methoxy-3-oxo-1,3-dihydro-2H-inden-1-yl}-2,2,2-trifluoroacetamide?
Yes, KEHONG BIO provides custom synthesis services for N-{2-[(Z)-(dimethylamino)methylidene]-5-ethoxy-6-methoxy-3-oxo-1,3-dihydro-2H-inden-1-yl}-2,2,2-trifluoroacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.