4-Caprinoyl-3-methyl-1-phenyl-5-pyrazolon
TL;DR: 4-Caprinoyl-3-methyl-1-phenyl-5-pyrazolon (CAS 76988-00-6) is a chemical compound with molecular formula C20H28N2O2 and molecular weight 328.2151 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-decanoyl-5-methyl-2-phenyl-1H-pyrazol-3-one
Also Known As: 4-decanoyl-5-methyl-2-phenyl-1H-pyrazol-3-one, 4-caprinoyl-3-methyl-1-phenyl-5-pyrazolon, 1-(5-Hydroxy-3-methyl-1-phenyl-1H-pyrazol-4-yl)-1-decanone, 1-(5-hydroxy-3-methyl-1-phenyl-1H-pyrazol-4-yl)decan-1-one, 2-amino-5-[(4-chlorophenyl)methylidene]-1,3-thiazol-4-one
Application Areas
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C20H28N2O2 |
| Molecular Weight | 328.2151 g/mol |
| XLogP | 5.8 |
| Topological Polar Surface Area (TPSA) | 49.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 10 |
| Exact Mass | 328.2151 Da |
| Heavy Atoms | 24 |
| Complexity | 464.0 |
| SMILES | CCCCCCCCCC(=O)C1=C(NN(C1=O)C2=CC=CC=C2)C |
| InChIKey | MSUBVJBCMVEPII-UHFFFAOYSA-N |
Chemical Property Profile of 4-Caprinoyl-3-methyl-1-phenyl-5-pyrazolon
Property Insights of 4-Caprinoyl-3-methyl-1-phenyl-5-pyrazolon
The XLogP value of 5.8 indicates that 4-Caprinoyl-3-methyl-1-phenyl-5-pyrazolon is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.4 Ų, 4-Caprinoyl-3-methyl-1-phenyl-5-pyrazolon exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Caprinoyl-3-methyl-1-phenyl-5-pyrazolon has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 4-Caprinoyl-3-methyl-1-phenyl-5-pyrazolon?
The CAS number of 4-Caprinoyl-3-methyl-1-phenyl-5-pyrazolon is 76988-00-6.
What is the molecular formula of 4-Caprinoyl-3-methyl-1-phenyl-5-pyrazolon?
The molecular formula of 4-Caprinoyl-3-methyl-1-phenyl-5-pyrazolon is C20H28N2O2.
What is the molecular weight of 4-Caprinoyl-3-methyl-1-phenyl-5-pyrazolon?
The molecular weight of 4-Caprinoyl-3-methyl-1-phenyl-5-pyrazolon is 328.2151 g/mol.
Where can I buy 4-Caprinoyl-3-methyl-1-phenyl-5-pyrazolon?
You can request a quote for 4-Caprinoyl-3-methyl-1-phenyl-5-pyrazolon directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-Caprinoyl-3-methyl-1-phenyl-5-pyrazolon?
Yes, CoreyChem provides custom synthesis services for 4-Caprinoyl-3-methyl-1-phenyl-5-pyrazolon and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.