4-((3-Nitro-1H-pyrazol-1-yl)methyl)benzoic acid hydrazide
TL;DR: 4-((3-Nitro-1H-pyrazol-1-yl)methyl)benzoic acid hydrazide (CAS 512809-79-9) 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.
4-[(3-nitropyrazol-1-yl)methyl]benzohydrazide
Also Known As: 4-[(3-nitropyrazol-1-yl)methyl]benzohydrazide, 4-[(3-nitro-1H-pyrazol-1-yl)methyl]benzohydrazide, 4-[(3-Nitro-1H-pyrazol-1-yl)methyl]benzoic acid hydrazide, 4-[(3-nitropyrazolyl)methyl]benzenecarbohydrazide, 4-({3-nitro-1H-pyrazol-1-yl}methyl)benzohydrazide
| Molecular Formula | C11H11N5O3 |
|---|---|
| Molecular Weight | 261.09 g/mol |
| LogP | 0.4431 |
| Topological Polar Surface Area | 116.08 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 261.08618 |
| Heavy Atoms | 19 |
| Complexity | 605.04816 |
Chemical Identifiers
| CAS Number | 512809-79-9 |
|---|---|
| SMILES | C1=CC(=CC=C1CN2C=CC(=N2)[N+](=O)[O-])C(=O)NN |
Product Overview
4-((3-Nitro-1H-pyrazol-1-yl)methyl)benzoic acid hydrazide (CAS 512809-79-9), with molecular formula C11H11N5O3 and molecular weight 261.09 g/mol. IUPAC: 4-[(3-nitropyrazol-1-yl)methyl]benzohydrazide.
Chemical Property Profile of 4-((3-Nitro-1H-pyrazol-1-yl)methyl)benzoic acid hydrazide
Property Insights of 4-((3-Nitro-1H-pyrazol-1-yl)methyl)benzoic acid hydrazide
The XLogP value of 0.4431 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-((3-Nitro-1H-pyrazol-1-yl)methyl)benzoic acid hydrazide. The TPSA of 116.08 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-((3-Nitro-1H-pyrazol-1-yl)methyl)benzoic acid hydrazide. Following Lipinski's Rule of Five, 4-((3-Nitro-1H-pyrazol-1-yl)methyl)benzoic acid hydrazide 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 4-((3-Nitro-1H-pyrazol-1-yl)methyl)benzoic acid hydrazide?
The CAS number of 4-((3-Nitro-1H-pyrazol-1-yl)methyl)benzoic acid hydrazide is 512809-79-9.
What is the molecular formula of 4-((3-Nitro-1H-pyrazol-1-yl)methyl)benzoic acid hydrazide?
The molecular formula of 4-((3-Nitro-1H-pyrazol-1-yl)methyl)benzoic acid hydrazide is C11H11N5O3.
What is the molecular weight of 4-((3-Nitro-1H-pyrazol-1-yl)methyl)benzoic acid hydrazide?
The molecular weight of 4-((3-Nitro-1H-pyrazol-1-yl)methyl)benzoic acid hydrazide is 261.09 g/mol.
Where can I buy 4-((3-Nitro-1H-pyrazol-1-yl)methyl)benzoic acid hydrazide?
You can request a quote for 4-((3-Nitro-1H-pyrazol-1-yl)methyl)benzoic acid hydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-((3-Nitro-1H-pyrazol-1-yl)methyl)benzoic acid hydrazide?
Yes, KEHONG BIO provides custom synthesis services for 4-((3-Nitro-1H-pyrazol-1-yl)methyl)benzoic acid hydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.