Menadione mono-p-nitrobenzoylhydrazone
TL;DR: Menadione mono-p-nitrobenzoylhydrazone (CAS 3161-55-5) is a chemical compound with molecular formula C18H13N3O4 and molecular weight 335.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-hydroxy-3-methylnaphthalen-1-yl)imino-4-nitrobenzamide
Also Known As: Menadione mono-p-nitrobenzoylhydrazone, Menadione, 4-p-nitrobenzoylhydrazone, N'-(3-Methyl-4-oxonaphthalen-1(4H)-ylidene)-4-nitrobenzohydrazide, N'-[(1E)-3-Methyl-4-oxonaphthalenylidene]-4-nitrobenzohydrazide #, 4-Nitrobenzoic acid 2-(3-methyl-4-oxo-1(4H)-naphthalenylidene)hydrazide
| Molecular Formula | C18H13N3O4 |
|---|---|
| Molecular Weight | 335.09 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 108.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 335.0906 |
| Heavy Atoms | 25 |
| Complexity | 525.0 |
Chemical Identifiers
| CAS Number | 3161-55-5 |
|---|---|
| SMILES | CC1=C(C2=CC=CC=C2C(=C1)N=NC(=O)C3=CC=C(C=C3)[N+](=O)[O-])O |
| InChIKey | KXCXXEBJIOMGGO-UHFFFAOYSA-N |
Product Overview
Menadione mono-p-nitrobenzoylhydrazone (CAS 3161-55-5), with molecular formula C18H13N3O4 and molecular weight 335.09 g/mol. IUPAC: N-(4-hydroxy-3-methylnaphthalen-1-yl)imino-4-nitrobenzamide.
Chemical Property Profile of Menadione mono-p-nitrobenzoylhydrazone
Property Insights of Menadione mono-p-nitrobenzoylhydrazone
The XLogP value of 4.7 indicates that Menadione mono-p-nitrobenzoylhydrazone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 108.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Menadione mono-p-nitrobenzoylhydrazone. Following Lipinski's Rule of Five, Menadione mono-p-nitrobenzoylhydrazone 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 Menadione mono-p-nitrobenzoylhydrazone?
The CAS number of Menadione mono-p-nitrobenzoylhydrazone is 3161-55-5.
What is the molecular formula of Menadione mono-p-nitrobenzoylhydrazone?
The molecular formula of Menadione mono-p-nitrobenzoylhydrazone is C18H13N3O4.
What is the molecular weight of Menadione mono-p-nitrobenzoylhydrazone?
The molecular weight of Menadione mono-p-nitrobenzoylhydrazone is 335.09 g/mol.
Where can I buy Menadione mono-p-nitrobenzoylhydrazone?
You can request a quote for Menadione mono-p-nitrobenzoylhydrazone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Menadione mono-p-nitrobenzoylhydrazone?
Yes, KEHONG BIO provides custom synthesis services for Menadione mono-p-nitrobenzoylhydrazone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.