N-[(E)-[4-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-3-methoxyphenyl]methylideneamino]-2-(3,5-dimethylphenoxy)acetamide
TL;DR: N-[(E)-[4-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-3-methoxyphenyl]methylideneamino]-2-(3,5-dimethylphenoxy)acetamide (CAS 515151-78-7) is a chemical compound with molecular formula C24H27BrN4O3 and molecular weight 498.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-[4-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-3-methoxyphenyl]methylideneamino]-2-(3,5-dimethylphenoxy)acetamide
Also Known As: N-[(E)-[4-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-3-methoxyphenyl]methylideneamino]-2-(3,5-dimethylphenoxy)acetamide, N'-{4-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-3-methoxybenzylidene}-2-(3,5-dimethylphenoxy)acetohydrazide, N'-[(E)-{4-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-3-methoxyphenyl}methylidene]-2-(3,5-dimethylphenoxy)acetohydrazide, N-((1E)-2-{4-[(4-bromo-3,5-dimethylpyrazolyl)methyl]-3-methoxyphenyl}-1-azavin yl)-2-(3,5-dimethylphenoxy)acetamide
| Molecular Formula | C24H27BrN4O3 |
|---|---|
| Molecular Weight | 498.13 g/mol |
| LogP | 4.46528 |
| Topological Polar Surface Area | 77.74 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 498.12665 |
| Heavy Atoms | 32 |
| Complexity | 1134.1364 |
Chemical Identifiers
| CAS Number | 515151-78-7 |
|---|---|
| SMILES | CC1=CC(=CC(=C1)OCC(=O)N/N=C/C2=CC(=C(C=C2)CN3C(=C(C(=N3)C)Br)C)OC)C |
Product Overview
N-[(E)-[4-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-3-methoxyphenyl]methylideneamino]-2-(3,5-dimethylphenoxy)acetamide (CAS 515151-78-7), with molecular formula C24H27BrN4O3 and molecular weight 498.13 g/mol. IUPAC: N-[(E)-[4-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-3-methoxyphenyl]methylideneamino]-2-(3,5-dimethylphenoxy)acetamide.
Chemical Property Profile of N-[(E)-[4-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-3-methoxyphenyl]methylideneamino]-2-(3,5-dimethylphenoxy)acetamide
Property Insights of N-[(E)-[4-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-3-methoxyphenyl]methylideneamino]-2-(3,5-dimethylphenoxy)acetamide
The XLogP value of 4.46528 indicates that N-[(E)-[4-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-3-methoxyphenyl]methylideneamino]-2-(3,5-dimethylphenoxy)acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.74 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(E)-[4-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-3-methoxyphenyl]methylideneamino]-2-(3,5-dimethylphenoxy)acetamide. Following Lipinski's Rule of Five, N-[(E)-[4-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-3-methoxyphenyl]methylideneamino]-2-(3,5-dimethylphenoxy)acetamide has 1 hydrogen bond donor(s) and 5 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 N-[(E)-[4-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-3-methoxyphenyl]methylideneamino]-2-(3,5-dimethylphenoxy)acetamide?
The CAS number of N-[(E)-[4-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-3-methoxyphenyl]methylideneamino]-2-(3,5-dimethylphenoxy)acetamide is 515151-78-7.
What is the molecular formula of N-[(E)-[4-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-3-methoxyphenyl]methylideneamino]-2-(3,5-dimethylphenoxy)acetamide?
The molecular formula of N-[(E)-[4-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-3-methoxyphenyl]methylideneamino]-2-(3,5-dimethylphenoxy)acetamide is C24H27BrN4O3.
What is the molecular weight of N-[(E)-[4-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-3-methoxyphenyl]methylideneamino]-2-(3,5-dimethylphenoxy)acetamide?
The molecular weight of N-[(E)-[4-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-3-methoxyphenyl]methylideneamino]-2-(3,5-dimethylphenoxy)acetamide is 498.13 g/mol.
Where can I buy N-[(E)-[4-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-3-methoxyphenyl]methylideneamino]-2-(3,5-dimethylphenoxy)acetamide?
You can request a quote for N-[(E)-[4-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-3-methoxyphenyl]methylideneamino]-2-(3,5-dimethylphenoxy)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(E)-[4-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-3-methoxyphenyl]methylideneamino]-2-(3,5-dimethylphenoxy)acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(E)-[4-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-3-methoxyphenyl]methylideneamino]-2-(3,5-dimethylphenoxy)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.