(E)-3-(3,4-dichlorophenyl)-N'-(3-nitrobenzylidene)-1H-pyrazole-5-carbohydrazide
TL;DR: (E)-3-(3,4-dichlorophenyl)-N'-(3-nitrobenzylidene)-1H-pyrazole-5-carbohydrazide (CAS 634898-85-4) is a chemical compound with molecular formula C17H11Cl2N5O3 and molecular weight 403.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3,4-dichlorophenyl)-N-[(E)-(3-nitrophenyl)methylideneamino]-1H-pyrazole-5-carboxamide
Also Known As: 3-(3,4-dichlorophenyl)-N'-[(E)-(3-nitrophenyl)methylidene]-1H-pyrazole-5-carbohydrazide, (E)-3-(3,4-dichlorophenyl)-N'-(3-nitrobenzylidene)-1H-pyrazole-5-carbohydrazide, 3-(3,4-dichlorophenyl)-N-[(E)-(3-nitrophenyl)methylideneamino]-1H-pyrazole-5-carboxamide, N-[(1E)-2-(3-nitrophenyl)-1-azavinyl][3-(3,4-dichlorophenyl)pyrazol-5-yl]carbo xamide
| Molecular Formula | C17H11Cl2N5O3 |
|---|---|
| Molecular Weight | 403.02 g/mol |
| LogP | 4.0556 |
| Topological Polar Surface Area | 113.28 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 403.0239 |
| Heavy Atoms | 27 |
| Complexity | 1048.5531 |
Chemical Identifiers
| CAS Number | 634898-85-4 |
|---|---|
| SMILES | C1=CC(=CC(=C1)[N+](=O)[O-])/C=N/NC(=O)C2=CC(=NN2)C3=CC(=C(C=C3)Cl)Cl |
Product Overview
(E)-3-(3,4-dichlorophenyl)-N'-(3-nitrobenzylidene)-1H-pyrazole-5-carbohydrazide (CAS 634898-85-4), with molecular formula C17H11Cl2N5O3 and molecular weight 403.02 g/mol. IUPAC: 3-(3,4-dichlorophenyl)-N-[(E)-(3-nitrophenyl)methylideneamino]-1H-pyrazole-5-carboxamide.
Chemical Property Profile of (E)-3-(3,4-dichlorophenyl)-N'-(3-nitrobenzylidene)-1H-pyrazole-5-carbohydrazide
Property Insights of (E)-3-(3,4-dichlorophenyl)-N'-(3-nitrobenzylidene)-1H-pyrazole-5-carbohydrazide
The XLogP value of 4.0556 indicates that (E)-3-(3,4-dichlorophenyl)-N'-(3-nitrobenzylidene)-1H-pyrazole-5-carbohydrazide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 113.28 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-3-(3,4-dichlorophenyl)-N'-(3-nitrobenzylidene)-1H-pyrazole-5-carbohydrazide. Following Lipinski's Rule of Five, (E)-3-(3,4-dichlorophenyl)-N'-(3-nitrobenzylidene)-1H-pyrazole-5-carbohydrazide 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 (E)-3-(3,4-dichlorophenyl)-N'-(3-nitrobenzylidene)-1H-pyrazole-5-carbohydrazide?
The CAS number of (E)-3-(3,4-dichlorophenyl)-N'-(3-nitrobenzylidene)-1H-pyrazole-5-carbohydrazide is 634898-85-4.
What is the molecular formula of (E)-3-(3,4-dichlorophenyl)-N'-(3-nitrobenzylidene)-1H-pyrazole-5-carbohydrazide?
The molecular formula of (E)-3-(3,4-dichlorophenyl)-N'-(3-nitrobenzylidene)-1H-pyrazole-5-carbohydrazide is C17H11Cl2N5O3.
What is the molecular weight of (E)-3-(3,4-dichlorophenyl)-N'-(3-nitrobenzylidene)-1H-pyrazole-5-carbohydrazide?
The molecular weight of (E)-3-(3,4-dichlorophenyl)-N'-(3-nitrobenzylidene)-1H-pyrazole-5-carbohydrazide is 403.02 g/mol.
Where can I buy (E)-3-(3,4-dichlorophenyl)-N'-(3-nitrobenzylidene)-1H-pyrazole-5-carbohydrazide?
You can request a quote for (E)-3-(3,4-dichlorophenyl)-N'-(3-nitrobenzylidene)-1H-pyrazole-5-carbohydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-3-(3,4-dichlorophenyl)-N'-(3-nitrobenzylidene)-1H-pyrazole-5-carbohydrazide?
Yes, KEHONG BIO provides custom synthesis services for (E)-3-(3,4-dichlorophenyl)-N'-(3-nitrobenzylidene)-1H-pyrazole-5-carbohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.