![Methyl 4-{(2E)-2-[4-(2-acetamido-3-methoxy-3-oxopropyl)-5-{(E)-[4-(methoxycarbonyl)phenyl]diazenyl}-2H-imidazol-2-ylidene]hydrazinyl}benzoate structure](/static/products/3903/39037-20-2.webp)
Methyl 4-{(2E)-2-[4-(2-acetamido-3-methoxy-3-oxopropyl)-5-{(E)-[4-(methoxycarbonyl)phenyl]diazenyl}-2H-imidazol-2-ylidene]hydrazinyl}benzoate
TL;DR: Methyl 4-{(2E)-2-[4-(2-acetamido-3-methoxy-3-oxopropyl)-5-{(E)-[4-(methoxycarbonyl)phenyl]diazenyl}-2H-imidazol-2-ylidene]hydrazinyl}benzoate (CAS 39037-20-2) is a chemical compound with molecular formula C25H25N7O7 and molecular weight 535.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[[5-(2-acetamido-3-methoxy-3-oxopropyl)-2-[(4-methoxycarbonylphenyl)diazenyl]-1H-imidazol-4-yl]diazenyl]benzoate
Also Known As: Methyl 4-{(2E)-2-[4-(2-acetamido-3-methoxy-3-oxopropyl)-5-{(E)-[4-(methoxycarbonyl)phenyl]diazenyl}-2H-imidazol-2-ylidene]hydrazinyl}benzoate, methyl 4-[2-[4-(2-acetamido-3-methoxy-3-oxopropyl)-5-[(4-methoxycarbonylphenyl)diazenyl]imidazol-2-ylidene]hydrazinyl]benzoate, Methyl 4-{(2E)-2-[4-(2-acetamido-3-methoxy-3-oxopropyl)-5-{(E)-[4-(methoxycarbonyl)phenyl]diazenyl}-2H-imidazol-2-ylidene]hydrazin-1-yl}benzoate
| Molecular Formula | C25H25N7O7 |
|---|---|
| Molecular Weight | 535.18 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 186.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 13 |
| Exact Mass | 535.1815 |
| Heavy Atoms | 39 |
| Complexity | 914.0 |
Chemical Identifiers
| CAS Number | 39037-20-2 |
|---|---|
| SMILES | CC(=O)NC(CC1=C(N=C(N1)N=NC2=CC=C(C=C2)C(=O)OC)N=NC3=CC=C(C=C3)C(=O)OC)C(=O)OC |
| InChIKey | NNWVIMAMWWWDMF-UHFFFAOYSA-N |
Product Overview
Methyl 4-{(2E)-2-[4-(2-acetamido-3-methoxy-3-oxopropyl)-5-{(E)-[4-(methoxycarbonyl)phenyl]diazenyl}-2H-imidazol-2-ylidene]hydrazinyl}benzoate (CAS 39037-20-2), with molecular formula C25H25N7O7 and molecular weight 535.18 g/mol. IUPAC: methyl 4-[[5-(2-acetamido-3-methoxy-3-oxopropyl)-2-[(4-methoxycarbonylphenyl)diazenyl]-1H-imidazol-4-yl]diazenyl]benzoate.
Chemical Property Profile of Methyl 4-{(2E)-2-[4-(2-acetamido-3-methoxy-3-oxopropyl)-5-{(E)-[4-(methoxycarbonyl)phenyl]diazenyl}-2H-imidazol-2-ylidene]hydrazinyl}benzoate
Property Insights of Methyl 4-{(2E)-2-[4-(2-acetamido-3-methoxy-3-oxopropyl)-5-{(E)-[4-(methoxycarbonyl)phenyl]diazenyl}-2H-imidazol-2-ylidene]hydrazinyl}benzoate
The XLogP value of 3.6 indicates that Methyl 4-{(2E)-2-[4-(2-acetamido-3-methoxy-3-oxopropyl)-5-{(E)-[4-(methoxycarbonyl)phenyl]diazenyl}-2H-imidazol-2-ylidene]hydrazinyl}benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 186.0 Ų indicates high polarity, suggesting Methyl 4-{(2E)-2-[4-(2-acetamido-3-methoxy-3-oxopropyl)-5-{(E)-[4-(methoxycarbonyl)phenyl]diazenyl}-2H-imidazol-2-ylidene]hydrazinyl}benzoate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Methyl 4-{(2E)-2-[4-(2-acetamido-3-methoxy-3-oxopropyl)-5-{(E)-[4-(methoxycarbonyl)phenyl]diazenyl}-2H-imidazol-2-ylidene]hydrazinyl}benzoate has 2 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Methyl 4-{(2E)-2-[4-(2-acetamido-3-methoxy-3-oxopropyl)-5-{(E)-[4-(methoxycarbonyl)phenyl]diazenyl}-2H-imidazol-2-ylidene]hydrazinyl}benzoate?
The CAS number of Methyl 4-{(2E)-2-[4-(2-acetamido-3-methoxy-3-oxopropyl)-5-{(E)-[4-(methoxycarbonyl)phenyl]diazenyl}-2H-imidazol-2-ylidene]hydrazinyl}benzoate is 39037-20-2.
What is the molecular formula of Methyl 4-{(2E)-2-[4-(2-acetamido-3-methoxy-3-oxopropyl)-5-{(E)-[4-(methoxycarbonyl)phenyl]diazenyl}-2H-imidazol-2-ylidene]hydrazinyl}benzoate?
The molecular formula of Methyl 4-{(2E)-2-[4-(2-acetamido-3-methoxy-3-oxopropyl)-5-{(E)-[4-(methoxycarbonyl)phenyl]diazenyl}-2H-imidazol-2-ylidene]hydrazinyl}benzoate is C25H25N7O7.
What is the molecular weight of Methyl 4-{(2E)-2-[4-(2-acetamido-3-methoxy-3-oxopropyl)-5-{(E)-[4-(methoxycarbonyl)phenyl]diazenyl}-2H-imidazol-2-ylidene]hydrazinyl}benzoate?
The molecular weight of Methyl 4-{(2E)-2-[4-(2-acetamido-3-methoxy-3-oxopropyl)-5-{(E)-[4-(methoxycarbonyl)phenyl]diazenyl}-2H-imidazol-2-ylidene]hydrazinyl}benzoate is 535.18 g/mol.
Where can I buy Methyl 4-{(2E)-2-[4-(2-acetamido-3-methoxy-3-oxopropyl)-5-{(E)-[4-(methoxycarbonyl)phenyl]diazenyl}-2H-imidazol-2-ylidene]hydrazinyl}benzoate?
You can request a quote for Methyl 4-{(2E)-2-[4-(2-acetamido-3-methoxy-3-oxopropyl)-5-{(E)-[4-(methoxycarbonyl)phenyl]diazenyl}-2H-imidazol-2-ylidene]hydrazinyl}benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 4-{(2E)-2-[4-(2-acetamido-3-methoxy-3-oxopropyl)-5-{(E)-[4-(methoxycarbonyl)phenyl]diazenyl}-2H-imidazol-2-ylidene]hydrazinyl}benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 4-{(2E)-2-[4-(2-acetamido-3-methoxy-3-oxopropyl)-5-{(E)-[4-(methoxycarbonyl)phenyl]diazenyl}-2H-imidazol-2-ylidene]hydrazinyl}benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.