N-[1-methyl-5-((Z)-{3-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl}methylidene)-4-oxodihydro-1H-imidazol-2-yliden]acetamide
TL;DR: N-[1-methyl-5-((Z)-{3-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl}methylidene)-4-oxodihydro-1H-imidazol-2-yliden]acetamide (CAS 866154-71-4) is a chemical compound with molecular formula C20H15F3N4O5 and molecular weight 448.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[1-methyl-5-[[3-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl]methylidene]-4-oxoimidazol-2-yl]acetamide
Also Known As: N-[1-methyl-5-((Z)-{3-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl}methylidene)-4-oxodihydro-1H-imidazol-2-yliden]acetamide, N-[1-methyl-5-[[3-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl]methylidene]-4-oxoimidazol-2-yl]acetamide
| Molecular Formula | C20H15F3N4O5 |
|---|---|
| Molecular Weight | 448.10 g/mol |
| LogP | 3.7109 |
| Topological Polar Surface Area | 114.14 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 448.09946 |
| Heavy Atoms | 32 |
| Complexity | 1174.0654 |
Chemical Identifiers
| CAS Number | 866154-71-4 |
|---|---|
| SMILES | CC(=O)NC1=NC(=O)C(=CC2=CC(=CC=C2)OC3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-])N1C |
Product Overview
N-[1-methyl-5-((Z)-{3-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl}methylidene)-4-oxodihydro-1H-imidazol-2-yliden]acetamide (CAS 866154-71-4), with molecular formula C20H15F3N4O5 and molecular weight 448.10 g/mol. IUPAC: N-[1-methyl-5-[[3-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl]methylidene]-4-oxoimidazol-2-yl]acetamide.
Chemical Property Profile of N-[1-methyl-5-((Z)-{3-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl}methylidene)-4-oxodihydro-1H-imidazol-2-yliden]acetamide
Property Insights of N-[1-methyl-5-((Z)-{3-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl}methylidene)-4-oxodihydro-1H-imidazol-2-yliden]acetamide
The XLogP value of 3.7109 indicates that N-[1-methyl-5-((Z)-{3-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl}methylidene)-4-oxodihydro-1H-imidazol-2-yliden]acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 114.14 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[1-methyl-5-((Z)-{3-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl}methylidene)-4-oxodihydro-1H-imidazol-2-yliden]acetamide. Following Lipinski's Rule of Five, N-[1-methyl-5-((Z)-{3-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl}methylidene)-4-oxodihydro-1H-imidazol-2-yliden]acetamide 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 N-[1-methyl-5-((Z)-{3-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl}methylidene)-4-oxodihydro-1H-imidazol-2-yliden]acetamide?
The CAS number of N-[1-methyl-5-((Z)-{3-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl}methylidene)-4-oxodihydro-1H-imidazol-2-yliden]acetamide is 866154-71-4.
What is the molecular formula of N-[1-methyl-5-((Z)-{3-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl}methylidene)-4-oxodihydro-1H-imidazol-2-yliden]acetamide?
The molecular formula of N-[1-methyl-5-((Z)-{3-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl}methylidene)-4-oxodihydro-1H-imidazol-2-yliden]acetamide is C20H15F3N4O5.
What is the molecular weight of N-[1-methyl-5-((Z)-{3-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl}methylidene)-4-oxodihydro-1H-imidazol-2-yliden]acetamide?
The molecular weight of N-[1-methyl-5-((Z)-{3-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl}methylidene)-4-oxodihydro-1H-imidazol-2-yliden]acetamide is 448.10 g/mol.
Where can I buy N-[1-methyl-5-((Z)-{3-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl}methylidene)-4-oxodihydro-1H-imidazol-2-yliden]acetamide?
You can request a quote for N-[1-methyl-5-((Z)-{3-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl}methylidene)-4-oxodihydro-1H-imidazol-2-yliden]acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[1-methyl-5-((Z)-{3-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl}methylidene)-4-oxodihydro-1H-imidazol-2-yliden]acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-[1-methyl-5-((Z)-{3-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl}methylidene)-4-oxodihydro-1H-imidazol-2-yliden]acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.