1-[4-(3,5-diphenyl-3,4-dihydropyrazol-2-yl)phenyl]-N-(4-nitrophenyl)methanimine structure

1-[4-(3,5-diphenyl-3,4-dihydropyrazol-2-yl)phenyl]-N-(4-nitrophenyl)methanimine

TL;DR: 1-[4-(3,5-diphenyl-3,4-dihydropyrazol-2-yl)phenyl]-N-(4-nitrophenyl)methanimine (CAS 5542-94-9) is a chemical compound with molecular formula C28H22N4O2 and molecular weight 446.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.

1-[4-(3,5-diphenyl-3,4-dihydropyrazol-2-yl)phenyl]-N-(4-nitrophenyl)methanimine

Also Known As: 1-[4-(3,5-diphenyl-3,4-dihydropyrazol-2-yl)phenyl]-N-(4-nitrophenyl)methanimine, (E)-1-[4-(3,5-Diphenyl-4,5-dihydro-1H-pyrazol-1-yl)phenyl]-N-(4-nitrophenyl)methanimine, 1-[4-(3,5-diphenyl-4,5-dihydropyrazol-1-yl)phenyl]-N-(4-nitrophenyl)methanimine

CAS: 5542-94-9
Molecular Formula C28H22N4O2
Molecular Weight 446.17 g/mol
LogP 6.7011
Topological Polar Surface Area 71.1 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 5
Rotatable Bonds 6
Exact Mass 446.1743
Heavy Atoms 34
Complexity 1333.0718

Chemical Identifiers

CAS Number 5542-94-9
SMILES C1C(N(N=C1C2=CC=CC=C2)C3=CC=C(C=C3)C=NC4=CC=C(C=C4)[N+](=O)[O-])C5=CC=CC=C5

Product Overview

1-[4-(3,5-diphenyl-3,4-dihydropyrazol-2-yl)phenyl]-N-(4-nitrophenyl)methanimine (CAS 5542-94-9), with molecular formula C28H22N4O2 and molecular weight 446.17 g/mol. IUPAC: 1-[4-(3,5-diphenyl-3,4-dihydropyrazol-2-yl)phenyl]-N-(4-nitrophenyl)methanimine.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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Chemical Property Profile of 1-[4-(3,5-diphenyl-3,4-dihydropyrazol-2-yl)phenyl]-N-(4-nitrophenyl)methanimine

XLogP
6.7011
TPSA (Topological Polar Surface Area)
71.1
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
5
Rotatable Bonds
6
Heavy Atoms
34
Complexity
1333.0718
Exact Mass
446.1743
Monoisotopic Mass
446.1743
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of 1-[4-(3,5-diphenyl-3,4-dihydropyrazol-2-yl)phenyl]-N-(4-nitrophenyl)methanimine

The XLogP value of 6.7011 indicates that 1-[4-(3,5-diphenyl-3,4-dihydropyrazol-2-yl)phenyl]-N-(4-nitrophenyl)methanimine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[4-(3,5-diphenyl-3,4-dihydropyrazol-2-yl)phenyl]-N-(4-nitrophenyl)methanimine. Following Lipinski's Rule of Five, 1-[4-(3,5-diphenyl-3,4-dihydropyrazol-2-yl)phenyl]-N-(4-nitrophenyl)methanimine has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the typical lead time for this product?
Lead time typically ranges from 3-7 business days for in-stock items. For larger quantities or custom orders, please contact us for specific lead times.
Can you provide samples for testing?
Yes, we offer sample quantities for quality testing. Please submit an inquiry with your requirements and we will arrange samples accordingly.
What documentation do you provide with the product?
We provide COA (Certificate of Analysis), MSDS (Material Safety Data Sheet), and technical data sheets with each shipment.
Do you ship internationally?
Yes, we ship to most countries worldwide. Shipping costs and delivery times vary by location. Please contact us for specific shipping information.

Frequently Asked Questions

What is the CAS number of 1-[4-(3,5-diphenyl-3,4-dihydropyrazol-2-yl)phenyl]-N-(4-nitrophenyl)methanimine?

The CAS number of 1-[4-(3,5-diphenyl-3,4-dihydropyrazol-2-yl)phenyl]-N-(4-nitrophenyl)methanimine is 5542-94-9.

What is the molecular formula of 1-[4-(3,5-diphenyl-3,4-dihydropyrazol-2-yl)phenyl]-N-(4-nitrophenyl)methanimine?

The molecular formula of 1-[4-(3,5-diphenyl-3,4-dihydropyrazol-2-yl)phenyl]-N-(4-nitrophenyl)methanimine is C28H22N4O2.

What is the molecular weight of 1-[4-(3,5-diphenyl-3,4-dihydropyrazol-2-yl)phenyl]-N-(4-nitrophenyl)methanimine?

The molecular weight of 1-[4-(3,5-diphenyl-3,4-dihydropyrazol-2-yl)phenyl]-N-(4-nitrophenyl)methanimine is 446.17 g/mol.

Where can I buy 1-[4-(3,5-diphenyl-3,4-dihydropyrazol-2-yl)phenyl]-N-(4-nitrophenyl)methanimine?

You can request a quote for 1-[4-(3,5-diphenyl-3,4-dihydropyrazol-2-yl)phenyl]-N-(4-nitrophenyl)methanimine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.

Does KEHONG BIO offer custom synthesis for 1-[4-(3,5-diphenyl-3,4-dihydropyrazol-2-yl)phenyl]-N-(4-nitrophenyl)methanimine?

Yes, KEHONG BIO provides custom synthesis services for 1-[4-(3,5-diphenyl-3,4-dihydropyrazol-2-yl)phenyl]-N-(4-nitrophenyl)methanimine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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