Benzaldehyde, 4-nitro-, (4-chloro-2-methyl-1(2H)-phthalazinylidene)hydrazone
TL;DR: Benzaldehyde, 4-nitro-, (4-chloro-2-methyl-1(2H)-phthalazinylidene)hydrazone (CAS 67458-35-9) is a chemical compound with molecular formula C16H12ClN5O2 and molecular weight 341.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-4-chloro-2-methyl-N-[(E)-(4-nitrophenyl)methylideneamino]phthalazin-1-imine
Also Known As: 2-Methyl-4-chlorophthalazone 4-nitrobenzylidenehydrazone, 4-Nitrobenzaldehyde (4-chloro-2-methyl-1(2H)-phthalazinylidene)hydrazone, BENZALDEHYDE, 4-NITRO-, (4-CHLORO-2-METHYL-1(2H)-PHTHALAZINYLIDENE)HYDRAZONE, RefChem:1077860, BRN 0898410
| Molecular Formula | C16H12ClN5O2 |
|---|---|
| Molecular Weight | 341.07 g/mol |
| LogP | 3.0697 |
| Topological Polar Surface Area | 85.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 341.06796 |
| Heavy Atoms | 24 |
| Complexity | 1009.14667 |
Chemical Identifiers
| CAS Number | 67458-35-9 |
|---|---|
| SMILES | CN1/C(=N/N=C/C2=CC=C(C=C2)[N+](=O)[O-])/C3=CC=CC=C3C(=N1)Cl |
Product Overview
Benzaldehyde, 4-nitro-, (4-chloro-2-methyl-1(2H)-phthalazinylidene)hydrazone (CAS 67458-35-9), with molecular formula C16H12ClN5O2 and molecular weight 341.07 g/mol. IUPAC: (E)-4-chloro-2-methyl-N-[(E)-(4-nitrophenyl)methylideneamino]phthalazin-1-imine.
Chemical Property Profile of Benzaldehyde, 4-nitro-, (4-chloro-2-methyl-1(2H)-phthalazinylidene)hydrazone
Property Insights of Benzaldehyde, 4-nitro-, (4-chloro-2-methyl-1(2H)-phthalazinylidene)hydrazone
The XLogP value of 3.0697 indicates that Benzaldehyde, 4-nitro-, (4-chloro-2-methyl-1(2H)-phthalazinylidene)hydrazone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.68 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzaldehyde, 4-nitro-, (4-chloro-2-methyl-1(2H)-phthalazinylidene)hydrazone. Following Lipinski's Rule of Five, Benzaldehyde, 4-nitro-, (4-chloro-2-methyl-1(2H)-phthalazinylidene)hydrazone has 0 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 Benzaldehyde, 4-nitro-, (4-chloro-2-methyl-1(2H)-phthalazinylidene)hydrazone?
The CAS number of Benzaldehyde, 4-nitro-, (4-chloro-2-methyl-1(2H)-phthalazinylidene)hydrazone is 67458-35-9.
What is the molecular formula of Benzaldehyde, 4-nitro-, (4-chloro-2-methyl-1(2H)-phthalazinylidene)hydrazone?
The molecular formula of Benzaldehyde, 4-nitro-, (4-chloro-2-methyl-1(2H)-phthalazinylidene)hydrazone is C16H12ClN5O2.
What is the molecular weight of Benzaldehyde, 4-nitro-, (4-chloro-2-methyl-1(2H)-phthalazinylidene)hydrazone?
The molecular weight of Benzaldehyde, 4-nitro-, (4-chloro-2-methyl-1(2H)-phthalazinylidene)hydrazone is 341.07 g/mol.
Where can I buy Benzaldehyde, 4-nitro-, (4-chloro-2-methyl-1(2H)-phthalazinylidene)hydrazone?
You can request a quote for Benzaldehyde, 4-nitro-, (4-chloro-2-methyl-1(2H)-phthalazinylidene)hydrazone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzaldehyde, 4-nitro-, (4-chloro-2-methyl-1(2H)-phthalazinylidene)hydrazone?
Yes, KEHONG BIO provides custom synthesis services for Benzaldehyde, 4-nitro-, (4-chloro-2-methyl-1(2H)-phthalazinylidene)hydrazone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.