(E)-methyl 4-((2-(3-(4-isobutylphenyl)-1H-pyrazole-5-carbonyl)hydrazono)methyl)benzoate
TL;DR: (E)-methyl 4-((2-(3-(4-isobutylphenyl)-1H-pyrazole-5-carbonyl)hydrazono)methyl)benzoate (CAS 1285530-81-5) is a chemical compound with molecular formula C23H24N4O3 and molecular weight 404.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[(E)-[[3-[4-(2-methylpropyl)phenyl]-1H-pyrazole-5-carbonyl]hydrazinylidene]methyl]benzoate
Also Known As: (E)-methyl 4-((2-(3-(4-isobutylphenyl)-1H-pyrazole-5-carbonyl)hydrazono)methyl)benzoate, methyl 4-[(E)-({[3-(4-isobutylphenyl)-1H-pyrazol-5-yl]carbonyl}hydrazono)methyl]benzoate, methyl 4-[(1E)-2-({3-[4-(2-methylpropyl)phenyl]pyrazol-5-yl}carbonylamino)-2-a zavinyl]benzoate, methyl 4-[(E)-[[3-[4-(2-methylpropyl)phenyl]-1H-pyrazole-5-carbonyl]hydrazinylidene]methyl]benzoate, methyl 4-{(E)-[2-({3-[4-(2-methylpropyl)phenyl]-1H-pyrazol-5-yl}carbonyl)hydrazinylidene]methyl}benzoate
| Molecular Formula | C23H24N4O3 |
|---|---|
| Molecular Weight | 404.18 g/mol |
| LogP | 3.8257 |
| Topological Polar Surface Area | 96.44 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 404.18484 |
| Heavy Atoms | 30 |
| Complexity | 1035.07 |
Chemical Identifiers
| CAS Number | 1285530-81-5 |
|---|---|
| SMILES | CC(C)CC1=CC=C(C=C1)C2=NNC(=C2)C(=O)N/N=C/C3=CC=C(C=C3)C(=O)OC |
Product Overview
(E)-methyl 4-((2-(3-(4-isobutylphenyl)-1H-pyrazole-5-carbonyl)hydrazono)methyl)benzoate (CAS 1285530-81-5), with molecular formula C23H24N4O3 and molecular weight 404.18 g/mol. IUPAC: methyl 4-[(E)-[[3-[4-(2-methylpropyl)phenyl]-1H-pyrazole-5-carbonyl]hydrazinylidene]methyl]benzoate.
Chemical Property Profile of (E)-methyl 4-((2-(3-(4-isobutylphenyl)-1H-pyrazole-5-carbonyl)hydrazono)methyl)benzoate
Property Insights of (E)-methyl 4-((2-(3-(4-isobutylphenyl)-1H-pyrazole-5-carbonyl)hydrazono)methyl)benzoate
The XLogP value of 3.8257 indicates that (E)-methyl 4-((2-(3-(4-isobutylphenyl)-1H-pyrazole-5-carbonyl)hydrazono)methyl)benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.44 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-methyl 4-((2-(3-(4-isobutylphenyl)-1H-pyrazole-5-carbonyl)hydrazono)methyl)benzoate. Following Lipinski's Rule of Five, (E)-methyl 4-((2-(3-(4-isobutylphenyl)-1H-pyrazole-5-carbonyl)hydrazono)methyl)benzoate has 2 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 (E)-methyl 4-((2-(3-(4-isobutylphenyl)-1H-pyrazole-5-carbonyl)hydrazono)methyl)benzoate?
The CAS number of (E)-methyl 4-((2-(3-(4-isobutylphenyl)-1H-pyrazole-5-carbonyl)hydrazono)methyl)benzoate is 1285530-81-5.
What is the molecular formula of (E)-methyl 4-((2-(3-(4-isobutylphenyl)-1H-pyrazole-5-carbonyl)hydrazono)methyl)benzoate?
The molecular formula of (E)-methyl 4-((2-(3-(4-isobutylphenyl)-1H-pyrazole-5-carbonyl)hydrazono)methyl)benzoate is C23H24N4O3.
What is the molecular weight of (E)-methyl 4-((2-(3-(4-isobutylphenyl)-1H-pyrazole-5-carbonyl)hydrazono)methyl)benzoate?
The molecular weight of (E)-methyl 4-((2-(3-(4-isobutylphenyl)-1H-pyrazole-5-carbonyl)hydrazono)methyl)benzoate is 404.18 g/mol.
Where can I buy (E)-methyl 4-((2-(3-(4-isobutylphenyl)-1H-pyrazole-5-carbonyl)hydrazono)methyl)benzoate?
You can request a quote for (E)-methyl 4-((2-(3-(4-isobutylphenyl)-1H-pyrazole-5-carbonyl)hydrazono)methyl)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-methyl 4-((2-(3-(4-isobutylphenyl)-1H-pyrazole-5-carbonyl)hydrazono)methyl)benzoate?
Yes, KEHONG BIO provides custom synthesis services for (E)-methyl 4-((2-(3-(4-isobutylphenyl)-1H-pyrazole-5-carbonyl)hydrazono)methyl)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.