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Methyl 4-[2-(4-bromobenzoyl)hydrazino]-4-oxobutanoate
TL;DR: Methyl 4-[2-(4-bromobenzoyl)hydrazino]-4-oxobutanoate (CAS 304453-64-3) is a chemical compound with molecular formula C12H13BrN2O4 and molecular weight 328.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[2-(4-bromobenzoyl)hydrazinyl]-4-oxobutanoate
Also Known As: methyl 4-[2-(4-bromobenzoyl)hydrazino]-4-oxobutanoate, BAS 00530972, methyl 4-[2-(4-bromobenzoyl)hydrazinyl]-4-oxobutanoate, methyl 4-[(4-bromophenyl)formohydrazido]-4-oxobutanoate, 4-[N'-(4-Bromo-benzoyl)-hydrazino]-4-oxo-butyric acid methyl ester
| Molecular Formula | C12H13BrN2O4 |
|---|---|
| Molecular Weight | 328.01 g/mol |
| LogP | 1.1633 |
| Topological Polar Surface Area | 84.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 328.00586 |
| Heavy Atoms | 19 |
| Complexity | 473.12265 |
Chemical Identifiers
| CAS Number | 304453-64-3 |
|---|---|
| SMILES | COC(=O)CCC(=O)NNC(=O)C1=CC=C(C=C1)Br |
Product Overview
Methyl 4-[2-(4-bromobenzoyl)hydrazino]-4-oxobutanoate (CAS 304453-64-3), with molecular formula C12H13BrN2O4 and molecular weight 328.01 g/mol. IUPAC: methyl 4-[2-(4-bromobenzoyl)hydrazinyl]-4-oxobutanoate.
Chemical Property Profile of Methyl 4-[2-(4-bromobenzoyl)hydrazino]-4-oxobutanoate
Property Insights of Methyl 4-[2-(4-bromobenzoyl)hydrazino]-4-oxobutanoate
The XLogP value of 1.1633 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 4-[2-(4-bromobenzoyl)hydrazino]-4-oxobutanoate. The TPSA of 84.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 4-[2-(4-bromobenzoyl)hydrazino]-4-oxobutanoate. Following Lipinski's Rule of Five, Methyl 4-[2-(4-bromobenzoyl)hydrazino]-4-oxobutanoate has 2 hydrogen bond donor(s) and 4 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-[2-(4-bromobenzoyl)hydrazino]-4-oxobutanoate?
The CAS number of Methyl 4-[2-(4-bromobenzoyl)hydrazino]-4-oxobutanoate is 304453-64-3.
What is the molecular formula of Methyl 4-[2-(4-bromobenzoyl)hydrazino]-4-oxobutanoate?
The molecular formula of Methyl 4-[2-(4-bromobenzoyl)hydrazino]-4-oxobutanoate is C12H13BrN2O4.
What is the molecular weight of Methyl 4-[2-(4-bromobenzoyl)hydrazino]-4-oxobutanoate?
The molecular weight of Methyl 4-[2-(4-bromobenzoyl)hydrazino]-4-oxobutanoate is 328.01 g/mol.
Where can I buy Methyl 4-[2-(4-bromobenzoyl)hydrazino]-4-oxobutanoate?
You can request a quote for Methyl 4-[2-(4-bromobenzoyl)hydrazino]-4-oxobutanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 4-[2-(4-bromobenzoyl)hydrazino]-4-oxobutanoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 4-[2-(4-bromobenzoyl)hydrazino]-4-oxobutanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.