4,5-dichloro-2-(4-fluorobenzyl)pyridazin-3(2H)-one
TL;DR: 4,5-dichloro-2-(4-fluorobenzyl)pyridazin-3(2H)-one (CAS 307508-07-2) is a chemical compound with molecular formula C11H7Cl2FN2O and molecular weight 271.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,5-dichloro-2-[(4-fluorophenyl)methyl]pyridazin-3-one
Also Known As: starbld0030578, 4,5-dichloro-2-(4-fluorobenzyl)pyridazin-3(2H)-one, 4,5-dichloro-2-[(4-fluorophenyl)methyl]pyridazin-3-one, BAS 02140639, 4,5-dichloro-2-(4-fluorobenzyl)pyridazin-3-one
| Molecular Formula | C11H7Cl2FN2O |
|---|---|
| Molecular Weight | 271.99 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 32.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 271.99194 |
| Heavy Atoms | 17 |
| Complexity | 376.0 |
Chemical Identifiers
| CAS Number | 307508-07-2 |
|---|---|
| SMILES | C1=CC(=CC=C1CN2C(=O)C(=C(C=N2)Cl)Cl)F |
| InChIKey | LLNJUQCJFCJEPC-UHFFFAOYSA-N |
Product Overview
4,5-dichloro-2-(4-fluorobenzyl)pyridazin-3(2H)-one (CAS 307508-07-2), with molecular formula C11H7Cl2FN2O and molecular weight 271.99 g/mol. IUPAC: 4,5-dichloro-2-[(4-fluorophenyl)methyl]pyridazin-3-one.
Chemical Property Profile of 4,5-dichloro-2-(4-fluorobenzyl)pyridazin-3(2H)-one
Property Insights of 4,5-dichloro-2-(4-fluorobenzyl)pyridazin-3(2H)-one
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,5-dichloro-2-(4-fluorobenzyl)pyridazin-3(2H)-one. With a topological polar surface area (TPSA) of 32.7 Ų, 4,5-dichloro-2-(4-fluorobenzyl)pyridazin-3(2H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,5-dichloro-2-(4-fluorobenzyl)pyridazin-3(2H)-one has 0 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 4,5-dichloro-2-(4-fluorobenzyl)pyridazin-3(2H)-one?
The CAS number of 4,5-dichloro-2-(4-fluorobenzyl)pyridazin-3(2H)-one is 307508-07-2.
What is the molecular formula of 4,5-dichloro-2-(4-fluorobenzyl)pyridazin-3(2H)-one?
The molecular formula of 4,5-dichloro-2-(4-fluorobenzyl)pyridazin-3(2H)-one is C11H7Cl2FN2O.
What is the molecular weight of 4,5-dichloro-2-(4-fluorobenzyl)pyridazin-3(2H)-one?
The molecular weight of 4,5-dichloro-2-(4-fluorobenzyl)pyridazin-3(2H)-one is 271.99 g/mol.
Where can I buy 4,5-dichloro-2-(4-fluorobenzyl)pyridazin-3(2H)-one?
You can request a quote for 4,5-dichloro-2-(4-fluorobenzyl)pyridazin-3(2H)-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-(4-fluorobenzyl)pyridazin-3(2H)-one?
Yes, KEHONG BIO provides custom synthesis services for 4,5-dichloro-2-(4-fluorobenzyl)pyridazin-3(2H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.