(E)-2-(3-((2-(4-((5-methyl-3-nitro-1H-pyrazol-1-yl)methyl)benzoyl)hydrazono)methyl)phenoxy)acetamide
TL;DR: (E)-2-(3-((2-(4-((5-methyl-3-nitro-1H-pyrazol-1-yl)methyl)benzoyl)hydrazono)methyl)phenoxy)acetamide (CAS 1004444-24-9) is a chemical compound with molecular formula C21H20N6O5 and molecular weight 436.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-[3-(2-amino-2-oxoethoxy)phenyl]methylideneamino]-4-[(5-methyl-3-nitropyrazol-1-yl)methyl]benzamide
Also Known As: (E)-2-(3-((2-(4-((5-methyl-3-nitro-1H-pyrazol-1-yl)methyl)benzoyl)hydrazono)methyl)phenoxy)acetamide, 2-(3-{(E)-[2-({4-[(5-methyl-3-nitro-1H-pyrazol-1-yl)methyl]phenyl}carbonyl)hydrazinylidene]methyl}phenoxy)acetamide, N-[(E)-[3-(2-amino-2-oxoethoxy)phenyl]methylideneamino]-4-[(5-methyl-3-nitropyrazol-1-yl)methyl]benzamide
| Molecular Formula | C21H20N6O5 |
|---|---|
| Molecular Weight | 436.15 g/mol |
| LogP | 1.77602 |
| Topological Polar Surface Area | 154.74 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 436.1495 |
| Heavy Atoms | 32 |
| Complexity | 1169.6782 |
Chemical Identifiers
| CAS Number | 1004444-24-9 |
|---|---|
| SMILES | CC1=CC(=NN1CC2=CC=C(C=C2)C(=O)N/N=C/C3=CC(=CC=C3)OCC(=O)N)[N+](=O)[O-] |
Product Overview
(E)-2-(3-((2-(4-((5-methyl-3-nitro-1H-pyrazol-1-yl)methyl)benzoyl)hydrazono)methyl)phenoxy)acetamide (CAS 1004444-24-9), with molecular formula C21H20N6O5 and molecular weight 436.15 g/mol. IUPAC: N-[(E)-[3-(2-amino-2-oxoethoxy)phenyl]methylideneamino]-4-[(5-methyl-3-nitropyrazol-1-yl)methyl]benzamide.
Chemical Property Profile of (E)-2-(3-((2-(4-((5-methyl-3-nitro-1H-pyrazol-1-yl)methyl)benzoyl)hydrazono)methyl)phenoxy)acetamide
Property Insights of (E)-2-(3-((2-(4-((5-methyl-3-nitro-1H-pyrazol-1-yl)methyl)benzoyl)hydrazono)methyl)phenoxy)acetamide
The XLogP value of 1.77602 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-2-(3-((2-(4-((5-methyl-3-nitro-1H-pyrazol-1-yl)methyl)benzoyl)hydrazono)methyl)phenoxy)acetamide. The TPSA of 154.74 Ų indicates high polarity, suggesting (E)-2-(3-((2-(4-((5-methyl-3-nitro-1H-pyrazol-1-yl)methyl)benzoyl)hydrazono)methyl)phenoxy)acetamide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, (E)-2-(3-((2-(4-((5-methyl-3-nitro-1H-pyrazol-1-yl)methyl)benzoyl)hydrazono)methyl)phenoxy)acetamide has 2 hydrogen bond donor(s) and 7 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 (E)-2-(3-((2-(4-((5-methyl-3-nitro-1H-pyrazol-1-yl)methyl)benzoyl)hydrazono)methyl)phenoxy)acetamide?
The CAS number of (E)-2-(3-((2-(4-((5-methyl-3-nitro-1H-pyrazol-1-yl)methyl)benzoyl)hydrazono)methyl)phenoxy)acetamide is 1004444-24-9.
What is the molecular formula of (E)-2-(3-((2-(4-((5-methyl-3-nitro-1H-pyrazol-1-yl)methyl)benzoyl)hydrazono)methyl)phenoxy)acetamide?
The molecular formula of (E)-2-(3-((2-(4-((5-methyl-3-nitro-1H-pyrazol-1-yl)methyl)benzoyl)hydrazono)methyl)phenoxy)acetamide is C21H20N6O5.
What is the molecular weight of (E)-2-(3-((2-(4-((5-methyl-3-nitro-1H-pyrazol-1-yl)methyl)benzoyl)hydrazono)methyl)phenoxy)acetamide?
The molecular weight of (E)-2-(3-((2-(4-((5-methyl-3-nitro-1H-pyrazol-1-yl)methyl)benzoyl)hydrazono)methyl)phenoxy)acetamide is 436.15 g/mol.
Where can I buy (E)-2-(3-((2-(4-((5-methyl-3-nitro-1H-pyrazol-1-yl)methyl)benzoyl)hydrazono)methyl)phenoxy)acetamide?
You can request a quote for (E)-2-(3-((2-(4-((5-methyl-3-nitro-1H-pyrazol-1-yl)methyl)benzoyl)hydrazono)methyl)phenoxy)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-2-(3-((2-(4-((5-methyl-3-nitro-1H-pyrazol-1-yl)methyl)benzoyl)hydrazono)methyl)phenoxy)acetamide?
Yes, KEHONG BIO provides custom synthesis services for (E)-2-(3-((2-(4-((5-methyl-3-nitro-1H-pyrazol-1-yl)methyl)benzoyl)hydrazono)methyl)phenoxy)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.