4-BR-2-(2-(Oxo(4-toluidino)acetyl)carbohydrazonoyl)phenyl 3,4-dimethoxybenzoate
TL;DR: 4-BR-2-(2-(Oxo(4-toluidino)acetyl)carbohydrazonoyl)phenyl 3,4-dimethoxybenzoate (CAS 769148-21-2) is a chemical compound with molecular formula C25H22BrN3O6 and molecular weight 539.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-bromo-2-[(E)-[[2-(4-methylanilino)-2-oxoacetyl]hydrazinylidene]methyl]phenyl] 3,4-dimethoxybenzoate
Also Known As: 4-BR-2-(2-(OXO(4-TOLUIDINO)ACETYL)CARBOHYDRAZONOYL)PHENYL 3,4-DIMETHOXYBENZOATE, [4-bromo-2-[[[(4-methylphenyl)carbamoylformyl]hydrazinylidene]methyl]phenyl] 3,4-dimethoxybenzoate, 637-983-6, RefChem:518778
| Molecular Formula | C25H22BrN3O6 |
|---|---|
| Molecular Weight | 539.07 g/mol |
| LogP | 4.08272 |
| Topological Polar Surface Area | 115.32 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 539.0692 |
| Heavy Atoms | 35 |
| Complexity | 1274.6938 |
Chemical Identifiers
| CAS Number | 769148-21-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC(=O)C(=O)N/N=C/C2=C(C=CC(=C2)Br)OC(=O)C3=CC(=C(C=C3)OC)OC |
Product Overview
4-BR-2-(2-(Oxo(4-toluidino)acetyl)carbohydrazonoyl)phenyl 3,4-dimethoxybenzoate (CAS 769148-21-2), with molecular formula C25H22BrN3O6 and molecular weight 539.07 g/mol. IUPAC: [4-bromo-2-[(E)-[[2-(4-methylanilino)-2-oxoacetyl]hydrazinylidene]methyl]phenyl] 3,4-dimethoxybenzoate.
Chemical Property Profile of 4-BR-2-(2-(Oxo(4-toluidino)acetyl)carbohydrazonoyl)phenyl 3,4-dimethoxybenzoate
Property Insights of 4-BR-2-(2-(Oxo(4-toluidino)acetyl)carbohydrazonoyl)phenyl 3,4-dimethoxybenzoate
The XLogP value of 4.08272 indicates that 4-BR-2-(2-(Oxo(4-toluidino)acetyl)carbohydrazonoyl)phenyl 3,4-dimethoxybenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 115.32 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-BR-2-(2-(Oxo(4-toluidino)acetyl)carbohydrazonoyl)phenyl 3,4-dimethoxybenzoate. Following Lipinski's Rule of Five, 4-BR-2-(2-(Oxo(4-toluidino)acetyl)carbohydrazonoyl)phenyl 3,4-dimethoxybenzoate has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-BR-2-(2-(Oxo(4-toluidino)acetyl)carbohydrazonoyl)phenyl 3,4-dimethoxybenzoate?
The CAS number of 4-BR-2-(2-(Oxo(4-toluidino)acetyl)carbohydrazonoyl)phenyl 3,4-dimethoxybenzoate is 769148-21-2.
What is the molecular formula of 4-BR-2-(2-(Oxo(4-toluidino)acetyl)carbohydrazonoyl)phenyl 3,4-dimethoxybenzoate?
The molecular formula of 4-BR-2-(2-(Oxo(4-toluidino)acetyl)carbohydrazonoyl)phenyl 3,4-dimethoxybenzoate is C25H22BrN3O6.
What is the molecular weight of 4-BR-2-(2-(Oxo(4-toluidino)acetyl)carbohydrazonoyl)phenyl 3,4-dimethoxybenzoate?
The molecular weight of 4-BR-2-(2-(Oxo(4-toluidino)acetyl)carbohydrazonoyl)phenyl 3,4-dimethoxybenzoate is 539.07 g/mol.
Where can I buy 4-BR-2-(2-(Oxo(4-toluidino)acetyl)carbohydrazonoyl)phenyl 3,4-dimethoxybenzoate?
You can request a quote for 4-BR-2-(2-(Oxo(4-toluidino)acetyl)carbohydrazonoyl)phenyl 3,4-dimethoxybenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-BR-2-(2-(Oxo(4-toluidino)acetyl)carbohydrazonoyl)phenyl 3,4-dimethoxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for 4-BR-2-(2-(Oxo(4-toluidino)acetyl)carbohydrazonoyl)phenyl 3,4-dimethoxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.