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(5-Methyl-3-nitro-pyrazol-1-yl)-acetic acid  [1-(4-benzyloxy-3-bromo-5-methoxy-phenyl)-meth-(E)-ylidene]-hydrazide structure
Fine Chemical

(5-Methyl-3-nitro-pyrazol-1-yl)-acetic acid [1-(4-benzyloxy-3-bromo-5-methoxy-phenyl)-meth-(E)-ylidene]-hydrazide

TL;DR: (5-Methyl-3-nitro-pyrazol-1-yl)-acetic acid [1-(4-benzyloxy-3-bromo-5-methoxy-phenyl)-meth-(E)-ylidene]-hydrazide (CAS 477767-18-3) is a chemical compound with molecular formula C21H20BrN5O5 and molecular weight 501.0648 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

N-[(E)-(3-bromo-5-methoxy-4-phenylmethoxyphenyl)methylideneamino]-2-(5-methyl-3-nitropyrazol-1-yl)acetamide

Also Known As: (5-Methyl-3-nitro-pyrazol-1-yl)-acetic acid [1-(4-benzyloxy-3-bromo-5-methoxy-phenyl)-meth-(E)-ylidene]-hydrazide, (E)-N'-(4-(benzyloxy)-3-bromo-5-methoxybenzylidene)-2-(5-methyl-3-nitro-1H-pyrazol-1-yl)acetohydrazide, N'-{(E)-[4-(benzyloxy)-3-bromo-5-methoxyphenyl]methylidene}-2-(5-methyl-3-nitro-1H-pyrazol-1-yl)acetohydrazide, N-[(E)-(3-bromo-5-methoxy-4-phenylmethoxyphenyl)methylideneamino]-2-(5-methyl-3-nitropyrazol-1-yl)acetamide

CAS Number
477767-18-3
Molecular Formula
C21H20BrN5O5
Molecular Weight
501.0648 g/mol
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Technical Specifications

Molecular FormulaC21H20BrN5O5
Molecular Weight501.0648 g/mol
XLogP4.0
Topological Polar Surface Area (TPSA)124.0 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors7
Rotatable Bonds8
Exact Mass501.0648 Da
Heavy Atoms32
Complexity657.0
SMILESCC1=CC(=NN1CC(=O)N/N=C/C2=CC(=C(C(=C2)Br)OCC3=CC=CC=C3)OC)[N+](=O)[O-]
InChIKeyUCGQTTSVVUDCPI-FOKLQQMPSA-N

Product Description

Applications: AC1OBOCM is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies AC1OBOCM (CAS 477767-18-3) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.

AC1OBOCM (CAS 477767-18-3) is a fine chemical with the molecular formula C21H20BrN5O5 and a molecular weight of 501.06 g/mol. It is also known as (5-Methyl-3-nitro-pyrazol-1-yl)-acetic acid [1-(4-benzyloxy-3-bromo-5-methoxy-phenyl)-meth-(E)-ylidene]-hydrazide and (E)-N'-(4-(benzyloxy)-3-bromo-5-methoxybenzylidene)-2-(5-methyl-3-nitro-1H-pyrazol-1-yl)acetohydrazide.

CoreyChem provides it with COA documentation, and custom synthesis from milligram to multi-kilogram scales is available on request. Request a quotation with your required quantity and purity for current lead time and pricing.

Chemical Property Profile of (5-Methyl-3-nitro-pyrazol-1-yl)-acetic acid [1-(4-benzyloxy-3-bromo-5-methoxy-phenyl)-meth-(E)-ylidene]-hydrazide

XLogP
4.0
TPSA (Topological Polar Surface Area)
124.0
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
7
Rotatable Bonds
8
Heavy Atoms
32
Complexity
657.0
Exact Mass
501.0648
Monoisotopic Mass
501.0648
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of (5-Methyl-3-nitro-pyrazol-1-yl)-acetic acid [1-(4-benzyloxy-3-bromo-5-methoxy-phenyl)-meth-(E)-ylidene]-hydrazide

The XLogP value of 4.0 indicates that (5-Methyl-3-nitro-pyrazol-1-yl)-acetic acid [1-(4-benzyloxy-3-bromo-5-methoxy-phenyl)-meth-(E)-ylidene]-hydrazide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 124.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (5-Methyl-3-nitro-pyrazol-1-yl)-acetic acid [1-(4-benzyloxy-3-bromo-5-methoxy-phenyl)-meth-(E)-ylidene]-hydrazide. Following Lipinski's Rule of Five, (5-Methyl-3-nitro-pyrazol-1-yl)-acetic acid [1-(4-benzyloxy-3-bromo-5-methoxy-phenyl)-meth-(E)-ylidene]-hydrazide has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of (5-Methyl-3-nitro-pyrazol-1-yl)-acetic acid [1-(4-benzyloxy-3-bromo-5-methoxy-phenyl)-meth-(E)-ylidene]-hydrazide?

The CAS number of (5-Methyl-3-nitro-pyrazol-1-yl)-acetic acid [1-(4-benzyloxy-3-bromo-5-methoxy-phenyl)-meth-(E)-ylidene]-hydrazide is 477767-18-3.

What is the molecular formula of (5-Methyl-3-nitro-pyrazol-1-yl)-acetic acid [1-(4-benzyloxy-3-bromo-5-methoxy-phenyl)-meth-(E)-ylidene]-hydrazide?

The molecular formula of (5-Methyl-3-nitro-pyrazol-1-yl)-acetic acid [1-(4-benzyloxy-3-bromo-5-methoxy-phenyl)-meth-(E)-ylidene]-hydrazide is C21H20BrN5O5.

What is the molecular weight of (5-Methyl-3-nitro-pyrazol-1-yl)-acetic acid [1-(4-benzyloxy-3-bromo-5-methoxy-phenyl)-meth-(E)-ylidene]-hydrazide?

The molecular weight of (5-Methyl-3-nitro-pyrazol-1-yl)-acetic acid [1-(4-benzyloxy-3-bromo-5-methoxy-phenyl)-meth-(E)-ylidene]-hydrazide is 501.0648 g/mol.

What are the applications of (5-Methyl-3-nitro-pyrazol-1-yl)-acetic acid [1-(4-benzyloxy-3-bromo-5-methoxy-phenyl)-meth-(E)-ylidene]-hydrazide?

AC1OBOCM is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies AC1OBOCM (CAS 477767-18-3) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.

Where can I buy (5-Methyl-3-nitro-pyrazol-1-yl)-acetic acid [1-(4-benzyloxy-3-bromo-5-methoxy-phenyl)-meth-(E)-ylidene]-hydrazide?

You can request a quote for (5-Methyl-3-nitro-pyrazol-1-yl)-acetic acid [1-(4-benzyloxy-3-bromo-5-methoxy-phenyl)-meth-(E)-ylidene]-hydrazide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for (5-Methyl-3-nitro-pyrazol-1-yl)-acetic acid [1-(4-benzyloxy-3-bromo-5-methoxy-phenyl)-meth-(E)-ylidene]-hydrazide?

Yes, CoreyChem provides custom synthesis services for (5-Methyl-3-nitro-pyrazol-1-yl)-acetic acid [1-(4-benzyloxy-3-bromo-5-methoxy-phenyl)-meth-(E)-ylidene]-hydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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