6-Chloro-3-phenyl-4-pyridazinyl 4-methylbenzoate
TL;DR: 6-Chloro-3-phenyl-4-pyridazinyl 4-methylbenzoate (CAS 77385-34-3) is a chemical compound with molecular formula C18H13ClN2O2 and molecular weight 324.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6-chloro-3-phenylpyridazin-4-yl) 4-methylbenzoate
Also Known As: 6-chloro-3-phenyl-4-pyridazinyl 4-methylbenzoate, (6-chloro-3-phenylpyridazin-4-yl) 4-methylbenzoate, AE-406/41057006
| Molecular Formula | C18H13ClN2O2 |
|---|---|
| Molecular Weight | 324.07 g/mol |
| LogP | 4.32462 |
| Topological Polar Surface Area | 52.08 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 324.06656 |
| Heavy Atoms | 23 |
| Complexity | 833.40027 |
Chemical Identifiers
| CAS Number | 77385-34-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)OC2=CC(=NN=C2C3=CC=CC=C3)Cl |
Product Overview
6-Chloro-3-phenyl-4-pyridazinyl 4-methylbenzoate (CAS 77385-34-3), with molecular formula C18H13ClN2O2 and molecular weight 324.07 g/mol. IUPAC: (6-chloro-3-phenylpyridazin-4-yl) 4-methylbenzoate.
Chemical Property Profile of 6-Chloro-3-phenyl-4-pyridazinyl 4-methylbenzoate
Property Insights of 6-Chloro-3-phenyl-4-pyridazinyl 4-methylbenzoate
The XLogP value of 4.32462 indicates that 6-Chloro-3-phenyl-4-pyridazinyl 4-methylbenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.08 Ų, 6-Chloro-3-phenyl-4-pyridazinyl 4-methylbenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Chloro-3-phenyl-4-pyridazinyl 4-methylbenzoate has 0 hydrogen bond donor(s) and 4 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-phenyl-4-pyridazinyl 4-methylbenzoate?
The CAS number of 6-Chloro-3-phenyl-4-pyridazinyl 4-methylbenzoate is 77385-34-3.
What is the molecular formula of 6-Chloro-3-phenyl-4-pyridazinyl 4-methylbenzoate?
The molecular formula of 6-Chloro-3-phenyl-4-pyridazinyl 4-methylbenzoate is C18H13ClN2O2.
What is the molecular weight of 6-Chloro-3-phenyl-4-pyridazinyl 4-methylbenzoate?
The molecular weight of 6-Chloro-3-phenyl-4-pyridazinyl 4-methylbenzoate is 324.07 g/mol.
Where can I buy 6-Chloro-3-phenyl-4-pyridazinyl 4-methylbenzoate?
You can request a quote for 6-Chloro-3-phenyl-4-pyridazinyl 4-methylbenzoate 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-phenyl-4-pyridazinyl 4-methylbenzoate?
Yes, KEHONG BIO provides custom synthesis services for 6-Chloro-3-phenyl-4-pyridazinyl 4-methylbenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.