5-Hydroxy-4-pentyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
TL;DR: 5-Hydroxy-4-pentyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one (CAS 54505-58-7) is a chemical compound with molecular formula C14H18N2O2 and molecular weight 246.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-pentyl-1-phenylpyrazolidine-3,5-dione
Also Known As: 4-Pentyl-1-phenyl-3,5-pyrazolidinedione, 4-Amyl-1-phenyl-3,5-dioxopyrazolidine, 3,5-Pyrazolidinedione, 4-pentyl-1-phenyl-, 4-pentyl-1-phenylpyrazolidine-3,5-dione, 5-24-05-00426 (Beilstein Handbook Reference)
| Molecular Formula | C14H18N2O2 |
|---|---|
| Molecular Weight | 246.14 g/mol |
| LogP | 2.2609 |
| Topological Polar Surface Area | 49.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 246.13683 |
| Heavy Atoms | 18 |
| Complexity | 430.67996 |
Chemical Identifiers
| CAS Number | 54505-58-7 |
|---|---|
| SMILES | CCCCCC1C(=O)NN(C1=O)C2=CC=CC=C2 |
Product Overview
5-Hydroxy-4-pentyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one (CAS 54505-58-7), with molecular formula C14H18N2O2 and molecular weight 246.14 g/mol. IUPAC: 4-pentyl-1-phenylpyrazolidine-3,5-dione.
Chemical Property Profile of 5-Hydroxy-4-pentyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Property Insights of 5-Hydroxy-4-pentyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
The XLogP value of 2.2609 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Hydroxy-4-pentyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one. With a topological polar surface area (TPSA) of 49.41 Ų, 5-Hydroxy-4-pentyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Hydroxy-4-pentyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one has 1 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-Hydroxy-4-pentyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one?
The CAS number of 5-Hydroxy-4-pentyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one is 54505-58-7.
What is the molecular formula of 5-Hydroxy-4-pentyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one?
The molecular formula of 5-Hydroxy-4-pentyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one is C14H18N2O2.
What is the molecular weight of 5-Hydroxy-4-pentyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one?
The molecular weight of 5-Hydroxy-4-pentyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one is 246.14 g/mol.
Where can I buy 5-Hydroxy-4-pentyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one?
You can request a quote for 5-Hydroxy-4-pentyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Hydroxy-4-pentyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one?
Yes, KEHONG BIO provides custom synthesis services for 5-Hydroxy-4-pentyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.