(E)-methyl 4-((2-(3-(5-methylfuran-2-yl)-1H-pyrazole-5-carbonyl)hydrazono)methyl)benzoate
TL;DR: (E)-methyl 4-((2-(3-(5-methylfuran-2-yl)-1H-pyrazole-5-carbonyl)hydrazono)methyl)benzoate (CAS 1285564-36-4) is a chemical compound with molecular formula C18H16N4O4 and molecular weight 352.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[(E)-[[5-(5-methylfuran-2-yl)-1H-pyrazole-3-carbonyl]hydrazinylidene]methyl]benzoate
Also Known As: (E)-methyl 4-((2-(3-(5-methylfuran-2-yl)-1H-pyrazole-5-carbonyl)hydrazono)methyl)benzoate, methyl 4-((1E)-2-{[3-(5-methyl(2-furyl))pyrazol-5-yl]carbonylamino}-2-azavinyl )benzoate, methyl 4-[(E)-({[3-(5-methyl-2-furyl)-1H-pyrazol-5-yl]carbonyl}hydrazono)methyl]benzoate, METHYL 4-[(E)-({[3-(5-METHYLFURAN-2-YL)-1H-PYRAZOL-5-YL]FORMAMIDO}IMINO)METHYL]BENZOATE, methyl 4-[(E)-(2-{[3-(5-methylfuran-2-yl)-1H-pyrazol-5-yl]carbonyl}hydrazinylidene)methyl]benzoate
| Molecular Formula | C18H16N4O4 |
|---|---|
| Molecular Weight | 352.12 g/mol |
| LogP | 2.52862 |
| Topological Polar Surface Area | 109.58 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 352.11716 |
| Heavy Atoms | 26 |
| Complexity | 953.7437 |
Chemical Identifiers
| CAS Number | 1285564-36-4 |
|---|---|
| SMILES | CC1=CC=C(O1)C2=CC(=NN2)C(=O)N/N=C/C3=CC=C(C=C3)C(=O)OC |
Product Overview
(E)-methyl 4-((2-(3-(5-methylfuran-2-yl)-1H-pyrazole-5-carbonyl)hydrazono)methyl)benzoate (CAS 1285564-36-4), with molecular formula C18H16N4O4 and molecular weight 352.12 g/mol. IUPAC: methyl 4-[(E)-[[5-(5-methylfuran-2-yl)-1H-pyrazole-3-carbonyl]hydrazinylidene]methyl]benzoate.
Chemical Property Profile of (E)-methyl 4-((2-(3-(5-methylfuran-2-yl)-1H-pyrazole-5-carbonyl)hydrazono)methyl)benzoate
Property Insights of (E)-methyl 4-((2-(3-(5-methylfuran-2-yl)-1H-pyrazole-5-carbonyl)hydrazono)methyl)benzoate
The XLogP value of 2.52862 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-methyl 4-((2-(3-(5-methylfuran-2-yl)-1H-pyrazole-5-carbonyl)hydrazono)methyl)benzoate. The TPSA of 109.58 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-methyl 4-((2-(3-(5-methylfuran-2-yl)-1H-pyrazole-5-carbonyl)hydrazono)methyl)benzoate. Following Lipinski's Rule of Five, (E)-methyl 4-((2-(3-(5-methylfuran-2-yl)-1H-pyrazole-5-carbonyl)hydrazono)methyl)benzoate has 2 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 (E)-methyl 4-((2-(3-(5-methylfuran-2-yl)-1H-pyrazole-5-carbonyl)hydrazono)methyl)benzoate?
The CAS number of (E)-methyl 4-((2-(3-(5-methylfuran-2-yl)-1H-pyrazole-5-carbonyl)hydrazono)methyl)benzoate is 1285564-36-4.
What is the molecular formula of (E)-methyl 4-((2-(3-(5-methylfuran-2-yl)-1H-pyrazole-5-carbonyl)hydrazono)methyl)benzoate?
The molecular formula of (E)-methyl 4-((2-(3-(5-methylfuran-2-yl)-1H-pyrazole-5-carbonyl)hydrazono)methyl)benzoate is C18H16N4O4.
What is the molecular weight of (E)-methyl 4-((2-(3-(5-methylfuran-2-yl)-1H-pyrazole-5-carbonyl)hydrazono)methyl)benzoate?
The molecular weight of (E)-methyl 4-((2-(3-(5-methylfuran-2-yl)-1H-pyrazole-5-carbonyl)hydrazono)methyl)benzoate is 352.12 g/mol.
Where can I buy (E)-methyl 4-((2-(3-(5-methylfuran-2-yl)-1H-pyrazole-5-carbonyl)hydrazono)methyl)benzoate?
You can request a quote for (E)-methyl 4-((2-(3-(5-methylfuran-2-yl)-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-(5-methylfuran-2-yl)-1H-pyrazole-5-carbonyl)hydrazono)methyl)benzoate?
Yes, KEHONG BIO provides custom synthesis services for (E)-methyl 4-((2-(3-(5-methylfuran-2-yl)-1H-pyrazole-5-carbonyl)hydrazono)methyl)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.