![1-{2-methoxy-5-[(E)-(2-phenylhydrazinylidene)methyl]benzyl}-4-nitro-1H-pyrazole structure](/static/products/304/304653-44-9.png)
1-{2-methoxy-5-[(E)-(2-phenylhydrazinylidene)methyl]benzyl}-4-nitro-1H-pyrazole
TL;DR: 1-{2-methoxy-5-[(E)-(2-phenylhydrazinylidene)methyl]benzyl}-4-nitro-1H-pyrazole (CAS 304653-44-9) is a chemical compound with molecular formula C18H17N5O3 and molecular weight 351.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-[4-methoxy-3-[(4-nitropyrazol-1-yl)methyl]phenyl]methylideneamino]aniline
Also Known As: (E)-1-(2-methoxy-5-((2-phenylhydrazono)methyl)benzyl)-4-nitro-1H-pyrazole, 1-{2-methoxy-5-[(E)-(2-phenylhydrazinylidene)methyl]benzyl}-4-nitro-1H-pyrazole
| Molecular Formula | C18H17N5O3 |
|---|---|
| Molecular Weight | 351.13 g/mol |
| LogP | 3.2942 |
| Topological Polar Surface Area | 94.58 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 351.13315 |
| Heavy Atoms | 26 |
| Complexity | 921.5858 |
Chemical Identifiers
| CAS Number | 304653-44-9 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)/C=N/NC2=CC=CC=C2)CN3C=C(C=N3)[N+](=O)[O-] |
Product Overview
1-{2-methoxy-5-[(E)-(2-phenylhydrazinylidene)methyl]benzyl}-4-nitro-1H-pyrazole (CAS 304653-44-9), with molecular formula C18H17N5O3 and molecular weight 351.13 g/mol. IUPAC: N-[(E)-[4-methoxy-3-[(4-nitropyrazol-1-yl)methyl]phenyl]methylideneamino]aniline.
Chemical Property Profile of 1-{2-methoxy-5-[(E)-(2-phenylhydrazinylidene)methyl]benzyl}-4-nitro-1H-pyrazole
Property Insights of 1-{2-methoxy-5-[(E)-(2-phenylhydrazinylidene)methyl]benzyl}-4-nitro-1H-pyrazole
The XLogP value of 3.2942 indicates that 1-{2-methoxy-5-[(E)-(2-phenylhydrazinylidene)methyl]benzyl}-4-nitro-1H-pyrazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.58 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-{2-methoxy-5-[(E)-(2-phenylhydrazinylidene)methyl]benzyl}-4-nitro-1H-pyrazole. Following Lipinski's Rule of Five, 1-{2-methoxy-5-[(E)-(2-phenylhydrazinylidene)methyl]benzyl}-4-nitro-1H-pyrazole has 1 hydrogen bond donor(s) and 6 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 1-{2-methoxy-5-[(E)-(2-phenylhydrazinylidene)methyl]benzyl}-4-nitro-1H-pyrazole?
The CAS number of 1-{2-methoxy-5-[(E)-(2-phenylhydrazinylidene)methyl]benzyl}-4-nitro-1H-pyrazole is 304653-44-9.
What is the molecular formula of 1-{2-methoxy-5-[(E)-(2-phenylhydrazinylidene)methyl]benzyl}-4-nitro-1H-pyrazole?
The molecular formula of 1-{2-methoxy-5-[(E)-(2-phenylhydrazinylidene)methyl]benzyl}-4-nitro-1H-pyrazole is C18H17N5O3.
What is the molecular weight of 1-{2-methoxy-5-[(E)-(2-phenylhydrazinylidene)methyl]benzyl}-4-nitro-1H-pyrazole?
The molecular weight of 1-{2-methoxy-5-[(E)-(2-phenylhydrazinylidene)methyl]benzyl}-4-nitro-1H-pyrazole is 351.13 g/mol.
Where can I buy 1-{2-methoxy-5-[(E)-(2-phenylhydrazinylidene)methyl]benzyl}-4-nitro-1H-pyrazole?
You can request a quote for 1-{2-methoxy-5-[(E)-(2-phenylhydrazinylidene)methyl]benzyl}-4-nitro-1H-pyrazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-{2-methoxy-5-[(E)-(2-phenylhydrazinylidene)methyl]benzyl}-4-nitro-1H-pyrazole?
Yes, KEHONG BIO provides custom synthesis services for 1-{2-methoxy-5-[(E)-(2-phenylhydrazinylidene)methyl]benzyl}-4-nitro-1H-pyrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.