acetyl}hydrazinylidene)methyl]benzoate structure](/static/products/352/352012-54-5.png)
methyl 4-[(E)-(2-{[(4-bromophenyl)amino](oxo)acetyl}hydrazinylidene)methyl]benzoate
TL;DR: methyl 4-[(E)-(2-{[(4-bromophenyl)amino](oxo)acetyl}hydrazinylidene)methyl]benzoate (CAS 352012-54-5) is a chemical compound with molecular formula C17H14BrN3O4 and molecular weight 403.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[(E)-[[2-(4-bromoanilino)-2-oxoacetyl]hydrazinylidene]methyl]benzoate
Also Known As: methyl 4-[(E)-(2-{[(4-bromophenyl)amino](oxo)acetyl}hydrazinylidene)methyl]benzoate, methyl 4-((E)-{[(4-bromoanilino)(oxo)acetyl]hydrazono}methyl)benzoate, (E)-methyl 4-((2-(2-((4-bromophenyl)amino)-2-oxoacetyl)hydrazono)methyl)benzoate, methyl 4-[(E)-[[2-(4-bromoanilino)-2-oxoacetyl]hydrazinylidene]methyl]benzoate
| Molecular Formula | C17H14BrN3O4 |
|---|---|
| Molecular Weight | 403.02 g/mol |
| LogP | 2.3245 |
| Topological Polar Surface Area | 96.86 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 403.01678 |
| Heavy Atoms | 25 |
| Complexity | 801.6476 |
Chemical Identifiers
| CAS Number | 352012-54-5 |
|---|---|
| SMILES | COC(=O)C1=CC=C(C=C1)/C=N/NC(=O)C(=O)NC2=CC=C(C=C2)Br |
Product Overview
methyl 4-[(E)-(2-{[(4-bromophenyl)amino](oxo)acetyl}hydrazinylidene)methyl]benzoate (CAS 352012-54-5), with molecular formula C17H14BrN3O4 and molecular weight 403.02 g/mol. IUPAC: methyl 4-[(E)-[[2-(4-bromoanilino)-2-oxoacetyl]hydrazinylidene]methyl]benzoate.
Chemical Property Profile of methyl 4-[(E)-(2-{[(4-bromophenyl)amino](oxo)acetyl}hydrazinylidene)methyl]benzoate
Property Insights of methyl 4-[(E)-(2-{[(4-bromophenyl)amino](oxo)acetyl}hydrazinylidene)methyl]benzoate
The XLogP value of 2.3245 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl 4-[(E)-(2-{[(4-bromophenyl)amino](oxo)acetyl}hydrazinylidene)methyl]benzoate. The TPSA of 96.86 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 4-[(E)-(2-{[(4-bromophenyl)amino](oxo)acetyl}hydrazinylidene)methyl]benzoate. Following Lipinski's Rule of Five, methyl 4-[(E)-(2-{[(4-bromophenyl)amino](oxo)acetyl}hydrazinylidene)methyl]benzoate has 2 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 methyl 4-[(E)-(2-{[(4-bromophenyl)amino](oxo)acetyl}hydrazinylidene)methyl]benzoate?
The CAS number of methyl 4-[(E)-(2-{[(4-bromophenyl)amino](oxo)acetyl}hydrazinylidene)methyl]benzoate is 352012-54-5.
What is the molecular formula of methyl 4-[(E)-(2-{[(4-bromophenyl)amino](oxo)acetyl}hydrazinylidene)methyl]benzoate?
The molecular formula of methyl 4-[(E)-(2-{[(4-bromophenyl)amino](oxo)acetyl}hydrazinylidene)methyl]benzoate is C17H14BrN3O4.
What is the molecular weight of methyl 4-[(E)-(2-{[(4-bromophenyl)amino](oxo)acetyl}hydrazinylidene)methyl]benzoate?
The molecular weight of methyl 4-[(E)-(2-{[(4-bromophenyl)amino](oxo)acetyl}hydrazinylidene)methyl]benzoate is 403.02 g/mol.
Where can I buy methyl 4-[(E)-(2-{[(4-bromophenyl)amino](oxo)acetyl}hydrazinylidene)methyl]benzoate?
You can request a quote for methyl 4-[(E)-(2-{[(4-bromophenyl)amino](oxo)acetyl}hydrazinylidene)methyl]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-[(E)-(2-{[(4-bromophenyl)amino](oxo)acetyl}hydrazinylidene)methyl]benzoate?
Yes, KEHONG BIO provides custom synthesis services for methyl 4-[(E)-(2-{[(4-bromophenyl)amino](oxo)acetyl}hydrazinylidene)methyl]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.