(Z)-ethyl 4-(4-(3,4-diethoxybenzylidene)-5-oxo-2-phenyl-4,5-dihydro-1H-imidazol-1-yl)benzoate
TL;DR: (Z)-ethyl 4-(4-(3,4-diethoxybenzylidene)-5-oxo-2-phenyl-4,5-dihydro-1H-imidazol-1-yl)benzoate (CAS 840464-20-2) is a chemical compound with molecular formula C29H28N2O5 and molecular weight 484.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[(4Z)-4-[(3,4-diethoxyphenyl)methylidene]-5-oxo-2-phenylimidazol-1-yl]benzoate
Also Known As: (Z)-ethyl 4-(4-(3,4-diethoxybenzylidene)-5-oxo-2-phenyl-4,5-dihydro-1H-imidazol-1-yl)benzoate, ethyl 4-[(4Z)-4-[(3,4-diethoxyphenyl)methylidene]-5-oxo-2-phenylimidazol-1-yl]benzoate, Ethyl 4-[4-[(3,4-diethoxyphenyl)methylidene]-5-oxo-2-phenyl-imidazol-1-yl]benzoate, ethyl 4-[(4Z)-4-(3,4-diethoxybenzylidene)-5-oxo-2-phenyl-4,5-dihydro-1H-imidazol-1-yl]benzoate
| Molecular Formula | C29H28N2O5 |
|---|---|
| Molecular Weight | 484.20 g/mol |
| LogP | 5.4952 |
| Topological Polar Surface Area | 77.43 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 484.19983 |
| Heavy Atoms | 36 |
| Complexity | 1296.9996 |
Chemical Identifiers
| CAS Number | 840464-20-2 |
|---|---|
| SMILES | CCOC1=C(C=C(C=C1)/C=C\2/C(=O)N(C(=N2)C3=CC=CC=C3)C4=CC=C(C=C4)C(=O)OCC)OCC |
Product Overview
(Z)-ethyl 4-(4-(3,4-diethoxybenzylidene)-5-oxo-2-phenyl-4,5-dihydro-1H-imidazol-1-yl)benzoate (CAS 840464-20-2), with molecular formula C29H28N2O5 and molecular weight 484.20 g/mol. IUPAC: ethyl 4-[(4Z)-4-[(3,4-diethoxyphenyl)methylidene]-5-oxo-2-phenylimidazol-1-yl]benzoate.
Chemical Property Profile of (Z)-ethyl 4-(4-(3,4-diethoxybenzylidene)-5-oxo-2-phenyl-4,5-dihydro-1H-imidazol-1-yl)benzoate
Property Insights of (Z)-ethyl 4-(4-(3,4-diethoxybenzylidene)-5-oxo-2-phenyl-4,5-dihydro-1H-imidazol-1-yl)benzoate
The XLogP value of 5.4952 indicates that (Z)-ethyl 4-(4-(3,4-diethoxybenzylidene)-5-oxo-2-phenyl-4,5-dihydro-1H-imidazol-1-yl)benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.43 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-ethyl 4-(4-(3,4-diethoxybenzylidene)-5-oxo-2-phenyl-4,5-dihydro-1H-imidazol-1-yl)benzoate. Following Lipinski's Rule of Five, (Z)-ethyl 4-(4-(3,4-diethoxybenzylidene)-5-oxo-2-phenyl-4,5-dihydro-1H-imidazol-1-yl)benzoate has 0 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 (Z)-ethyl 4-(4-(3,4-diethoxybenzylidene)-5-oxo-2-phenyl-4,5-dihydro-1H-imidazol-1-yl)benzoate?
The CAS number of (Z)-ethyl 4-(4-(3,4-diethoxybenzylidene)-5-oxo-2-phenyl-4,5-dihydro-1H-imidazol-1-yl)benzoate is 840464-20-2.
What is the molecular formula of (Z)-ethyl 4-(4-(3,4-diethoxybenzylidene)-5-oxo-2-phenyl-4,5-dihydro-1H-imidazol-1-yl)benzoate?
The molecular formula of (Z)-ethyl 4-(4-(3,4-diethoxybenzylidene)-5-oxo-2-phenyl-4,5-dihydro-1H-imidazol-1-yl)benzoate is C29H28N2O5.
What is the molecular weight of (Z)-ethyl 4-(4-(3,4-diethoxybenzylidene)-5-oxo-2-phenyl-4,5-dihydro-1H-imidazol-1-yl)benzoate?
The molecular weight of (Z)-ethyl 4-(4-(3,4-diethoxybenzylidene)-5-oxo-2-phenyl-4,5-dihydro-1H-imidazol-1-yl)benzoate is 484.20 g/mol.
Where can I buy (Z)-ethyl 4-(4-(3,4-diethoxybenzylidene)-5-oxo-2-phenyl-4,5-dihydro-1H-imidazol-1-yl)benzoate?
You can request a quote for (Z)-ethyl 4-(4-(3,4-diethoxybenzylidene)-5-oxo-2-phenyl-4,5-dihydro-1H-imidazol-1-yl)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-ethyl 4-(4-(3,4-diethoxybenzylidene)-5-oxo-2-phenyl-4,5-dihydro-1H-imidazol-1-yl)benzoate?
Yes, KEHONG BIO provides custom synthesis services for (Z)-ethyl 4-(4-(3,4-diethoxybenzylidene)-5-oxo-2-phenyl-4,5-dihydro-1H-imidazol-1-yl)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.