![(5-Methyl-3-nitro-pyrazol-1-yl)-acetic acid [1-(4-benzyloxy-3-bromo-5-methoxy-phenyl)-meth-(E)-ylidene]-hydrazide structure](/static/products/477/477767-18-3.png)
(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 501.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
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
| Molecular Formula | C21H20BrN5O5 |
|---|---|
| Molecular Weight | 501.06 g/mol |
| LogP | 3.60012 |
| Topological Polar Surface Area | 120.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 501.0648 |
| Heavy Atoms | 32 |
| Complexity | 1146.9822 |
Chemical Identifiers
| CAS Number | 477767-18-3 |
|---|---|
| SMILES | CC1=CC(=NN1CC(=O)N/N=C/C2=CC(=C(C(=C2)Br)OCC3=CC=CC=C3)OC)[N+](=O)[O-] |
Product Overview
(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), with molecular formula C21H20BrN5O5 and molecular weight 501.06 g/mol. IUPAC: N-[(E)-(3-bromo-5-methoxy-4-phenylmethoxyphenyl)methylideneamino]-2-(5-methyl-3-nitropyrazol-1-yl)acetamide.
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
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 3.60012 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 120.88 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
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 501.06 g/mol.
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 KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO 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, KEHONG BIO 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.