5-Chloro-4-[methoxy(phenyl)methyl]-1-methyl-3-phenylpyrazole
TL;DR: 5-Chloro-4-[methoxy(phenyl)methyl]-1-methyl-3-phenylpyrazole (CAS 956181-56-9) is a chemical compound with molecular formula C18H17ClN2O and molecular weight 312.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-chloro-4-[methoxy(phenyl)methyl]-1-methyl-3-phenylpyrazole
Also Known As: 5-chloro-4-[methoxy(phenyl)methyl]-1-methyl-3-phenylpyrazole, 5-chloro-4-[methoxy(phenyl)methyl]-1-methyl-3-phenyl-1H-pyrazole
| Molecular Formula | C18H17ClN2O |
|---|---|
| Molecular Weight | 312.10 g/mol |
| LogP | 4.4763 |
| Topological Polar Surface Area | 27.05 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 312.10294 |
| Heavy Atoms | 22 |
| Complexity | 753.5181 |
Chemical Identifiers
| CAS Number | 956181-56-9 |
|---|---|
| SMILES | CN1C(=C(C(=N1)C2=CC=CC=C2)C(C3=CC=CC=C3)OC)Cl |
Product Overview
5-Chloro-4-[methoxy(phenyl)methyl]-1-methyl-3-phenylpyrazole (CAS 956181-56-9), with molecular formula C18H17ClN2O and molecular weight 312.10 g/mol. IUPAC: 5-chloro-4-[methoxy(phenyl)methyl]-1-methyl-3-phenylpyrazole.
Chemical Property Profile of 5-Chloro-4-[methoxy(phenyl)methyl]-1-methyl-3-phenylpyrazole
Property Insights of 5-Chloro-4-[methoxy(phenyl)methyl]-1-methyl-3-phenylpyrazole
The XLogP value of 4.4763 indicates that 5-Chloro-4-[methoxy(phenyl)methyl]-1-methyl-3-phenylpyrazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 27.05 Ų, 5-Chloro-4-[methoxy(phenyl)methyl]-1-methyl-3-phenylpyrazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Chloro-4-[methoxy(phenyl)methyl]-1-methyl-3-phenylpyrazole 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 5-Chloro-4-[methoxy(phenyl)methyl]-1-methyl-3-phenylpyrazole?
The CAS number of 5-Chloro-4-[methoxy(phenyl)methyl]-1-methyl-3-phenylpyrazole is 956181-56-9.
What is the molecular formula of 5-Chloro-4-[methoxy(phenyl)methyl]-1-methyl-3-phenylpyrazole?
The molecular formula of 5-Chloro-4-[methoxy(phenyl)methyl]-1-methyl-3-phenylpyrazole is C18H17ClN2O.
What is the molecular weight of 5-Chloro-4-[methoxy(phenyl)methyl]-1-methyl-3-phenylpyrazole?
The molecular weight of 5-Chloro-4-[methoxy(phenyl)methyl]-1-methyl-3-phenylpyrazole is 312.10 g/mol.
Where can I buy 5-Chloro-4-[methoxy(phenyl)methyl]-1-methyl-3-phenylpyrazole?
You can request a quote for 5-Chloro-4-[methoxy(phenyl)methyl]-1-methyl-3-phenylpyrazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Chloro-4-[methoxy(phenyl)methyl]-1-methyl-3-phenylpyrazole?
Yes, KEHONG BIO provides custom synthesis services for 5-Chloro-4-[methoxy(phenyl)methyl]-1-methyl-3-phenylpyrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.