Proxifezone
TL;DR: Proxifezone (CAS 3563-81-3) is a chemical compound with molecular formula C41H49N3O4 and molecular weight 647.37 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-butyl-5-oxo-1,2-diphenylpyrazol-3-olate;dimethyl-(2-methyl-3,4-diphenyl-3-propanoyloxybutyl)azanium
Also Known As: Proxifezone, 4-(dimethylamino)-3-methyl-1,2-diphenylbutan-2-yl propanoate- 4-butyl-5-hydroxy-1,2-diphenyl-1,2-dihydro-3h-pyrazol-3-one(1:1), 4-butyl-5-oxo-1,2-diphenylpyrazol-3-olate; dimethyl-(2-methyl-3,4-diphenyl-3-propanoyloxybutyl)azanium
| Molecular Formula | C41H49N3O4 |
|---|---|
| Molecular Weight | 647.37 g/mol |
| LogP | 5.9 |
| Topological Polar Surface Area | 77.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 14 |
| Exact Mass | 647.3723 |
| Heavy Atoms | 48 |
| Complexity | 808.0 |
Chemical Identifiers
| CAS Number | 3563-81-3 |
|---|---|
| SMILES | CCCCC1=C(N(N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3)[O-].CCC(=O)OC(CC1=CC=CC=C1)(C2=CC=CC=C2)C(C)C[NH+](C)C |
| InChIKey | IUTSUHBXMNNSGZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Proxifezone (CAS 3563-81-3), with molecular formula C41H49N3O4 and molecular weight 647.37 g/mol. IUPAC: 4-butyl-5-oxo-1,2-diphenylpyrazol-3-olate;dimethyl-(2-methyl-3,4-diphenyl-3-propanoyloxybutyl)azanium.
Chemical Property Profile of Proxifezone
Property Insights of Proxifezone
The XLogP value of 5.9 indicates that Proxifezone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Proxifezone. Following Lipinski's Rule of Five, Proxifezone has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Proxifezone?
The CAS number of Proxifezone is 3563-81-3.
What is the molecular formula of Proxifezone?
The molecular formula of Proxifezone is C41H49N3O4.
What is the molecular weight of Proxifezone?
The molecular weight of Proxifezone is 647.37 g/mol.
Where can I buy Proxifezone?
You can request a quote for Proxifezone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Proxifezone?
Yes, KEHONG BIO provides custom synthesis services for Proxifezone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.