4,5-Dichloro-2-((2-chlorophenyl)methyl)-2,3-dihydropyridazin-3-one
TL;DR: 4,5-Dichloro-2-((2-chlorophenyl)methyl)-2,3-dihydropyridazin-3-one (CAS 112749-52-7) is a chemical compound with molecular formula C11H7Cl3N2O and molecular weight 287.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,5-dichloro-2-[(2-chlorophenyl)methyl]pyridazin-3-one
Also Known As: EcDsbB-IN-12, EcDsbB-IN-10, 4,5-dichloro-2-[(2-chlorophenyl)methyl]-2,3-dihydropyridazin-3-one, 4,5-dichloro-2-(2-chlorobenzyl)pyridazin-3(2H)-one, 4,5-dichloro-2-[(2-chlorophenyl)methyl]pyridazin-3-one
| Molecular Formula | C11H7Cl3N2O |
|---|---|
| Molecular Weight | 287.96 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 32.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 287.9624 |
| Heavy Atoms | 17 |
| Complexity | 381.0 |
Chemical Identifiers
| CAS Number | 112749-52-7 |
|---|---|
| SMILES | C1=CC=C(C(=C1)CN2C(=O)C(=C(C=N2)Cl)Cl)Cl |
| InChIKey | OCSOJUHXYHYEKJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4,5-Dichloro-2-((2-chlorophenyl)methyl)-2,3-dihydropyridazin-3-one (CAS 112749-52-7), with molecular formula C11H7Cl3N2O and molecular weight 287.96 g/mol. IUPAC: 4,5-dichloro-2-[(2-chlorophenyl)methyl]pyridazin-3-one.
Chemical Property Profile of 4,5-Dichloro-2-((2-chlorophenyl)methyl)-2,3-dihydropyridazin-3-one
Property Insights of 4,5-Dichloro-2-((2-chlorophenyl)methyl)-2,3-dihydropyridazin-3-one
The XLogP value of 3.3 indicates that 4,5-Dichloro-2-((2-chlorophenyl)methyl)-2,3-dihydropyridazin-3-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.7 Ų, 4,5-Dichloro-2-((2-chlorophenyl)methyl)-2,3-dihydropyridazin-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,5-Dichloro-2-((2-chlorophenyl)methyl)-2,3-dihydropyridazin-3-one has 0 hydrogen bond donor(s) and 2 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 4,5-Dichloro-2-((2-chlorophenyl)methyl)-2,3-dihydropyridazin-3-one?
The CAS number of 4,5-Dichloro-2-((2-chlorophenyl)methyl)-2,3-dihydropyridazin-3-one is 112749-52-7.
What is the molecular formula of 4,5-Dichloro-2-((2-chlorophenyl)methyl)-2,3-dihydropyridazin-3-one?
The molecular formula of 4,5-Dichloro-2-((2-chlorophenyl)methyl)-2,3-dihydropyridazin-3-one is C11H7Cl3N2O.
What is the molecular weight of 4,5-Dichloro-2-((2-chlorophenyl)methyl)-2,3-dihydropyridazin-3-one?
The molecular weight of 4,5-Dichloro-2-((2-chlorophenyl)methyl)-2,3-dihydropyridazin-3-one is 287.96 g/mol.
Where can I buy 4,5-Dichloro-2-((2-chlorophenyl)methyl)-2,3-dihydropyridazin-3-one?
You can request a quote for 4,5-Dichloro-2-((2-chlorophenyl)methyl)-2,3-dihydropyridazin-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,5-Dichloro-2-((2-chlorophenyl)methyl)-2,3-dihydropyridazin-3-one?
Yes, KEHONG BIO provides custom synthesis services for 4,5-Dichloro-2-((2-chlorophenyl)methyl)-2,3-dihydropyridazin-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.