Methyldesphenylchloridazon
TL;DR: Methyldesphenylchloridazon (CAS 17254-80-7) is a chemical compound with molecular formula C5H6ClN3O and molecular weight 159.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-amino-4-chloro-2-methylpyridazin-3-one
Also Known As: Methyldesphenylchloridazon, chloridazon TP2, CHLORIDAZON-METHYL-DESPHENYL, Chloridazon metabolite, Chloridazon Impurity 2
| Molecular Formula | C5H6ClN3O |
|---|---|
| Molecular Weight | 159.02 g/mol |
| LogP | -0.2 |
| Topological Polar Surface Area | 58.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 159.01994 |
| Heavy Atoms | 10 |
| Complexity | 233.0 |
Chemical Identifiers
| CAS Number | 17254-80-7 |
|---|---|
| SMILES | CN1C(=O)C(=C(C=N1)N)Cl |
| InChIKey | XNSGCNYTNLWRKM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methyldesphenylchloridazon (CAS 17254-80-7), with molecular formula C5H6ClN3O and molecular weight 159.02 g/mol. IUPAC: 5-amino-4-chloro-2-methylpyridazin-3-one.
Chemical Property Profile of Methyldesphenylchloridazon
Property Insights of Methyldesphenylchloridazon
The XLogP value of -0.2 indicates that Methyldesphenylchloridazon is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 58.7 Ų, Methyldesphenylchloridazon exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyldesphenylchloridazon has 1 hydrogen bond donor(s) and 3 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 Methyldesphenylchloridazon?
The CAS number of Methyldesphenylchloridazon is 17254-80-7.
What is the molecular formula of Methyldesphenylchloridazon?
The molecular formula of Methyldesphenylchloridazon is C5H6ClN3O.
What is the molecular weight of Methyldesphenylchloridazon?
The molecular weight of Methyldesphenylchloridazon is 159.02 g/mol.
Where can I buy Methyldesphenylchloridazon?
You can request a quote for Methyldesphenylchloridazon directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyldesphenylchloridazon?
Yes, KEHONG BIO provides custom synthesis services for Methyldesphenylchloridazon and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.