4-Iodo-2H-pyrazole-3-carboxylic acid (4-nitro-benzylidene)-hydrazide
TL;DR: 4-Iodo-2H-pyrazole-3-carboxylic acid (4-nitro-benzylidene)-hydrazide (CAS 353245-58-6) is a chemical compound with molecular formula C11H8IN5O3 and molecular weight 384.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-iodo-N-[(E)-(4-nitrophenyl)methylideneamino]-1H-pyrazole-5-carboxamide
Also Known As: BAS 00506935, 4-Iodo-2H-pyrazole-3-carboxylic acid (4-nitro-benzylidene)-hydrazide, 4-iodo-N-[(E)-(4-nitrophenyl)methylideneamino]-1H-pyrazole-5-carboxamide, 4-Iodo-N'-(4-nitrobenzylidene)-1H-pyrazole-5-carbohydrazide, N'-{4-nitrobenzylidene}-4-iodo-1H-pyrazole-5-carbohydrazide
| Molecular Formula | C11H8IN5O3 |
|---|---|
| Molecular Weight | 384.97 g/mol |
| LogP | 1.6864 |
| Topological Polar Surface Area | 113.28 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 384.9672 |
| Heavy Atoms | 20 |
| Complexity | 664.95306 |
Chemical Identifiers
| CAS Number | 353245-58-6 |
|---|---|
| SMILES | C1=CC(=CC=C1/C=N/NC(=O)C2=C(C=NN2)I)[N+](=O)[O-] |
Product Overview
4-Iodo-2H-pyrazole-3-carboxylic acid (4-nitro-benzylidene)-hydrazide (CAS 353245-58-6), with molecular formula C11H8IN5O3 and molecular weight 384.97 g/mol. IUPAC: 4-iodo-N-[(E)-(4-nitrophenyl)methylideneamino]-1H-pyrazole-5-carboxamide.
Chemical Property Profile of 4-Iodo-2H-pyrazole-3-carboxylic acid (4-nitro-benzylidene)-hydrazide
Property Insights of 4-Iodo-2H-pyrazole-3-carboxylic acid (4-nitro-benzylidene)-hydrazide
The XLogP value of 1.6864 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Iodo-2H-pyrazole-3-carboxylic acid (4-nitro-benzylidene)-hydrazide. The TPSA of 113.28 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Iodo-2H-pyrazole-3-carboxylic acid (4-nitro-benzylidene)-hydrazide. Following Lipinski's Rule of Five, 4-Iodo-2H-pyrazole-3-carboxylic acid (4-nitro-benzylidene)-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-Iodo-2H-pyrazole-3-carboxylic acid (4-nitro-benzylidene)-hydrazide?
The CAS number of 4-Iodo-2H-pyrazole-3-carboxylic acid (4-nitro-benzylidene)-hydrazide is 353245-58-6.
What is the molecular formula of 4-Iodo-2H-pyrazole-3-carboxylic acid (4-nitro-benzylidene)-hydrazide?
The molecular formula of 4-Iodo-2H-pyrazole-3-carboxylic acid (4-nitro-benzylidene)-hydrazide is C11H8IN5O3.
What is the molecular weight of 4-Iodo-2H-pyrazole-3-carboxylic acid (4-nitro-benzylidene)-hydrazide?
The molecular weight of 4-Iodo-2H-pyrazole-3-carboxylic acid (4-nitro-benzylidene)-hydrazide is 384.97 g/mol.
Where can I buy 4-Iodo-2H-pyrazole-3-carboxylic acid (4-nitro-benzylidene)-hydrazide?
You can request a quote for 4-Iodo-2H-pyrazole-3-carboxylic acid (4-nitro-benzylidene)-hydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Iodo-2H-pyrazole-3-carboxylic acid (4-nitro-benzylidene)-hydrazide?
Yes, KEHONG BIO provides custom synthesis services for 4-Iodo-2H-pyrazole-3-carboxylic acid (4-nitro-benzylidene)-hydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.