![methyl 2-[2-(3-amino-5-oxopyrazol-4-yl)hydrazinyl]benzoate structure](/static/products/500/500147-50-2.png)
methyl 2-[2-(3-amino-5-oxopyrazol-4-yl)hydrazinyl]benzoate
TL;DR: methyl 2-[2-(3-amino-5-oxopyrazol-4-yl)hydrazinyl]benzoate (CAS 500147-50-2) is a chemical compound with molecular formula C11H11N5O3 and molecular weight 261.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[(3-amino-5-oxo-1,2-dihydropyrazol-4-yl)diazenyl]benzoate
Also Known As: methyl 2-[2-(3-amino-5-oxopyrazol-4-yl)hydrazinyl]benzoate, METHYL 2-{2-[(4E)-3-AMINO-5-OXO-4,5-DIHYDRO-1H-PYRAZOL-4-YLIDENE]HYDRAZIN-1-YL}BENZOATE, (Z)-methyl 2-(2-(3-amino-5-oxo-1H-pyrazol-4(5H)-ylidene)hydrazinyl)benzoate, methyl 2-[(2Z)-2-(3-amino-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene)hydrazinyl]benzoate, 2-{N'-[3-Amino-5-oxo-1,5-dihydro-pyrazol-(4Z)-ylidene]-hydrazino}-benzoic acid methyl ester
| Molecular Formula | C11H11N5O3 |
|---|---|
| Molecular Weight | 261.09 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 118.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 261.08618 |
| Heavy Atoms | 19 |
| Complexity | 446.0 |
Chemical Identifiers
| CAS Number | 500147-50-2 |
|---|---|
| SMILES | COC(=O)C1=CC=CC=C1N=NC2=C(NNC2=O)N |
| InChIKey | VODSFIGVXIAVLX-UHFFFAOYSA-N |
Product Overview
methyl 2-[2-(3-amino-5-oxopyrazol-4-yl)hydrazinyl]benzoate (CAS 500147-50-2), with molecular formula C11H11N5O3 and molecular weight 261.09 g/mol. IUPAC: methyl 2-[(3-amino-5-oxo-1,2-dihydropyrazol-4-yl)diazenyl]benzoate.
Chemical Property Profile of methyl 2-[2-(3-amino-5-oxopyrazol-4-yl)hydrazinyl]benzoate
Property Insights of methyl 2-[2-(3-amino-5-oxopyrazol-4-yl)hydrazinyl]benzoate
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl 2-[2-(3-amino-5-oxopyrazol-4-yl)hydrazinyl]benzoate. The TPSA of 118.0 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 2-[2-(3-amino-5-oxopyrazol-4-yl)hydrazinyl]benzoate. Following Lipinski's Rule of Five, methyl 2-[2-(3-amino-5-oxopyrazol-4-yl)hydrazinyl]benzoate has 3 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 methyl 2-[2-(3-amino-5-oxopyrazol-4-yl)hydrazinyl]benzoate?
The CAS number of methyl 2-[2-(3-amino-5-oxopyrazol-4-yl)hydrazinyl]benzoate is 500147-50-2.
What is the molecular formula of methyl 2-[2-(3-amino-5-oxopyrazol-4-yl)hydrazinyl]benzoate?
The molecular formula of methyl 2-[2-(3-amino-5-oxopyrazol-4-yl)hydrazinyl]benzoate is C11H11N5O3.
What is the molecular weight of methyl 2-[2-(3-amino-5-oxopyrazol-4-yl)hydrazinyl]benzoate?
The molecular weight of methyl 2-[2-(3-amino-5-oxopyrazol-4-yl)hydrazinyl]benzoate is 261.09 g/mol.
Where can I buy methyl 2-[2-(3-amino-5-oxopyrazol-4-yl)hydrazinyl]benzoate?
You can request a quote for methyl 2-[2-(3-amino-5-oxopyrazol-4-yl)hydrazinyl]benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 2-[2-(3-amino-5-oxopyrazol-4-yl)hydrazinyl]benzoate?
Yes, KEHONG BIO provides custom synthesis services for methyl 2-[2-(3-amino-5-oxopyrazol-4-yl)hydrazinyl]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.