4-iodo-1-methyl-N'-[(E)-(4-nitrophenyl)methylidene]-1H-pyrazole-3-carbohydrazide
TL;DR: 4-iodo-1-methyl-N'-[(E)-(4-nitrophenyl)methylidene]-1H-pyrazole-3-carbohydrazide (CAS 353245-52-0) is a chemical compound with molecular formula C12H10IN5O3 and molecular weight 398.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-iodo-1-methyl-N-[(E)-(4-nitrophenyl)methylideneamino]pyrazole-3-carboxamide
Also Known As: BAS 00396174, 4-iodo-1-methyl-N'-[(E)-(4-nitrophenyl)methylidene]-1H-pyrazole-3-carbohydrazide, (E)-4-iodo-1-methyl-N'-(4-nitrobenzylidene)-1H-pyrazole-3-carbohydrazide, 4-Iodo-1-methyl-1H-pyrazole-3-carboxylic acid (4-nitro-benzylidene)-hydrazide, 4-iodo-1-methyl-N-[(E)-(4-nitrophenyl)methylideneamino]pyrazole-3-carboxamide
| Molecular Formula | C12H10IN5O3 |
|---|---|
| Molecular Weight | 398.98 g/mol |
| LogP | 1.6968 |
| Topological Polar Surface Area | 102.42 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 398.98285 |
| Heavy Atoms | 21 |
| Complexity | 708.18304 |
Chemical Identifiers
| CAS Number | 353245-52-0 |
|---|---|
| SMILES | CN1C=C(C(=N1)C(=O)N/N=C/C2=CC=C(C=C2)[N+](=O)[O-])I |
Product Overview
4-iodo-1-methyl-N'-[(E)-(4-nitrophenyl)methylidene]-1H-pyrazole-3-carbohydrazide (CAS 353245-52-0), with molecular formula C12H10IN5O3 and molecular weight 398.98 g/mol. IUPAC: 4-iodo-1-methyl-N-[(E)-(4-nitrophenyl)methylideneamino]pyrazole-3-carboxamide.
Chemical Property Profile of 4-iodo-1-methyl-N'-[(E)-(4-nitrophenyl)methylidene]-1H-pyrazole-3-carbohydrazide
Property Insights of 4-iodo-1-methyl-N'-[(E)-(4-nitrophenyl)methylidene]-1H-pyrazole-3-carbohydrazide
The XLogP value of 1.6968 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-iodo-1-methyl-N'-[(E)-(4-nitrophenyl)methylidene]-1H-pyrazole-3-carbohydrazide. The TPSA of 102.42 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-iodo-1-methyl-N'-[(E)-(4-nitrophenyl)methylidene]-1H-pyrazole-3-carbohydrazide. Following Lipinski's Rule of Five, 4-iodo-1-methyl-N'-[(E)-(4-nitrophenyl)methylidene]-1H-pyrazole-3-carbohydrazide has 1 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-1-methyl-N'-[(E)-(4-nitrophenyl)methylidene]-1H-pyrazole-3-carbohydrazide?
The CAS number of 4-iodo-1-methyl-N'-[(E)-(4-nitrophenyl)methylidene]-1H-pyrazole-3-carbohydrazide is 353245-52-0.
What is the molecular formula of 4-iodo-1-methyl-N'-[(E)-(4-nitrophenyl)methylidene]-1H-pyrazole-3-carbohydrazide?
The molecular formula of 4-iodo-1-methyl-N'-[(E)-(4-nitrophenyl)methylidene]-1H-pyrazole-3-carbohydrazide is C12H10IN5O3.
What is the molecular weight of 4-iodo-1-methyl-N'-[(E)-(4-nitrophenyl)methylidene]-1H-pyrazole-3-carbohydrazide?
The molecular weight of 4-iodo-1-methyl-N'-[(E)-(4-nitrophenyl)methylidene]-1H-pyrazole-3-carbohydrazide is 398.98 g/mol.
Where can I buy 4-iodo-1-methyl-N'-[(E)-(4-nitrophenyl)methylidene]-1H-pyrazole-3-carbohydrazide?
You can request a quote for 4-iodo-1-methyl-N'-[(E)-(4-nitrophenyl)methylidene]-1H-pyrazole-3-carbohydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-iodo-1-methyl-N'-[(E)-(4-nitrophenyl)methylidene]-1H-pyrazole-3-carbohydrazide?
Yes, KEHONG BIO provides custom synthesis services for 4-iodo-1-methyl-N'-[(E)-(4-nitrophenyl)methylidene]-1H-pyrazole-3-carbohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.