![3-[[3-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxyanilino]methylidene]-1-pyrimidin-2-ylpyrrolidin-2-one structure](/static/products/3389/338954-33-9.webp)
3-[[3-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxyanilino]methylidene]-1-pyrimidin-2-ylpyrrolidin-2-one
TL;DR: 3-[[3-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxyanilino]methylidene]-1-pyrimidin-2-ylpyrrolidin-2-one (CAS 338954-33-9) is a chemical compound with molecular formula C21H15ClF3N5O2 and molecular weight 461.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[3-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy]anilino]methylidene]-1-pyrimidin-2-ylpyrrolidin-2-one
Also Known As: 3-[[3-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxyanilino]methylidene]-1-pyrimidin-2-ylpyrrolidin-2-one, 3-[(3-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy}anilino)methylene]-1-(2-pyrimidinyl)-2-pyrrolidinone
| Molecular Formula | C21H15ClF3N5O2 |
|---|---|
| Molecular Weight | 461.09 g/mol |
| LogP | 5.0688 |
| Topological Polar Surface Area | 80.24 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 461.08664 |
| Heavy Atoms | 32 |
| Complexity | 1171.5968 |
Chemical Identifiers
| CAS Number | 338954-33-9 |
|---|---|
| SMILES | C1CN(C(=O)C1=CNC2=CC(=CC=C2)OC3=C(C=C(C=N3)C(F)(F)F)Cl)C4=NC=CC=N4 |
Product Overview
3-[[3-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxyanilino]methylidene]-1-pyrimidin-2-ylpyrrolidin-2-one (CAS 338954-33-9), with molecular formula C21H15ClF3N5O2 and molecular weight 461.09 g/mol. IUPAC: 3-[[3-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy]anilino]methylidene]-1-pyrimidin-2-ylpyrrolidin-2-one.
Chemical Property Profile of 3-[[3-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxyanilino]methylidene]-1-pyrimidin-2-ylpyrrolidin-2-one
Property Insights of 3-[[3-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxyanilino]methylidene]-1-pyrimidin-2-ylpyrrolidin-2-one
The XLogP value of 5.0688 indicates that 3-[[3-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxyanilino]methylidene]-1-pyrimidin-2-ylpyrrolidin-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.24 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[[3-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxyanilino]methylidene]-1-pyrimidin-2-ylpyrrolidin-2-one. Following Lipinski's Rule of Five, 3-[[3-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxyanilino]methylidene]-1-pyrimidin-2-ylpyrrolidin-2-one has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-[[3-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxyanilino]methylidene]-1-pyrimidin-2-ylpyrrolidin-2-one?
The CAS number of 3-[[3-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxyanilino]methylidene]-1-pyrimidin-2-ylpyrrolidin-2-one is 338954-33-9.
What is the molecular formula of 3-[[3-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxyanilino]methylidene]-1-pyrimidin-2-ylpyrrolidin-2-one?
The molecular formula of 3-[[3-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxyanilino]methylidene]-1-pyrimidin-2-ylpyrrolidin-2-one is C21H15ClF3N5O2.
What is the molecular weight of 3-[[3-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxyanilino]methylidene]-1-pyrimidin-2-ylpyrrolidin-2-one?
The molecular weight of 3-[[3-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxyanilino]methylidene]-1-pyrimidin-2-ylpyrrolidin-2-one is 461.09 g/mol.
Where can I buy 3-[[3-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxyanilino]methylidene]-1-pyrimidin-2-ylpyrrolidin-2-one?
You can request a quote for 3-[[3-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxyanilino]methylidene]-1-pyrimidin-2-ylpyrrolidin-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[[3-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxyanilino]methylidene]-1-pyrimidin-2-ylpyrrolidin-2-one?
Yes, KEHONG BIO provides custom synthesis services for 3-[[3-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxyanilino]methylidene]-1-pyrimidin-2-ylpyrrolidin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.