![6-Chloro-3-(4-nitrophenyl)-[1,2,4]triazolo[3,4-a]phthalazine structure](/static/products/6745/67458-39-3.webp)
6-Chloro-3-(4-nitrophenyl)-[1,2,4]triazolo[3,4-a]phthalazine
TL;DR: 6-Chloro-3-(4-nitrophenyl)-[1,2,4]triazolo[3,4-a]phthalazine (CAS 67458-39-3) is a chemical compound with molecular formula C15H8ClN5O2 and molecular weight 325.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-3-(4-nitrophenyl)-[1,2,4]triazolo[3,4-a]phthalazine
Also Known As: 6-chloro-3-(4-nitrophenyl)-[1,2,4]triazolo[3,4-a]phthalazine, 6-Chloro-3-(4-nitrophenyl)-1,2,4-triazolo[3,4-a]phthalazine, 6-Chloro-3-(4-nitrophenyl)[1,2,4]triazolo[3,4-a]phthalazine
| Molecular Formula | C15H8ClN5O2 |
|---|---|
| Molecular Weight | 325.04 g/mol |
| LogP | 3.5061 |
| Topological Polar Surface Area | 86.22 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 325.03665 |
| Heavy Atoms | 23 |
| Complexity | 1058.7902 |
Chemical Identifiers
| CAS Number | 67458-39-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C3=NN=C(N3N=C2Cl)C4=CC=C(C=C4)[N+](=O)[O-] |
Product Overview
6-Chloro-3-(4-nitrophenyl)-[1,2,4]triazolo[3,4-a]phthalazine (CAS 67458-39-3), with molecular formula C15H8ClN5O2 and molecular weight 325.04 g/mol. IUPAC: 6-chloro-3-(4-nitrophenyl)-[1,2,4]triazolo[3,4-a]phthalazine.
Chemical Property Profile of 6-Chloro-3-(4-nitrophenyl)-[1,2,4]triazolo[3,4-a]phthalazine
Property Insights of 6-Chloro-3-(4-nitrophenyl)-[1,2,4]triazolo[3,4-a]phthalazine
The XLogP value of 3.5061 indicates that 6-Chloro-3-(4-nitrophenyl)-[1,2,4]triazolo[3,4-a]phthalazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.22 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Chloro-3-(4-nitrophenyl)-[1,2,4]triazolo[3,4-a]phthalazine. Following Lipinski's Rule of Five, 6-Chloro-3-(4-nitrophenyl)-[1,2,4]triazolo[3,4-a]phthalazine 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 6-Chloro-3-(4-nitrophenyl)-[1,2,4]triazolo[3,4-a]phthalazine?
The CAS number of 6-Chloro-3-(4-nitrophenyl)-[1,2,4]triazolo[3,4-a]phthalazine is 67458-39-3.
What is the molecular formula of 6-Chloro-3-(4-nitrophenyl)-[1,2,4]triazolo[3,4-a]phthalazine?
The molecular formula of 6-Chloro-3-(4-nitrophenyl)-[1,2,4]triazolo[3,4-a]phthalazine is C15H8ClN5O2.
What is the molecular weight of 6-Chloro-3-(4-nitrophenyl)-[1,2,4]triazolo[3,4-a]phthalazine?
The molecular weight of 6-Chloro-3-(4-nitrophenyl)-[1,2,4]triazolo[3,4-a]phthalazine is 325.04 g/mol.
Where can I buy 6-Chloro-3-(4-nitrophenyl)-[1,2,4]triazolo[3,4-a]phthalazine?
You can request a quote for 6-Chloro-3-(4-nitrophenyl)-[1,2,4]triazolo[3,4-a]phthalazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Chloro-3-(4-nitrophenyl)-[1,2,4]triazolo[3,4-a]phthalazine?
Yes, KEHONG BIO provides custom synthesis services for 6-Chloro-3-(4-nitrophenyl)-[1,2,4]triazolo[3,4-a]phthalazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.