4,4-Dimethyl-1-(4-methylphenyl)-5-propoxypyrazolidin-3-one
TL;DR: 4,4-Dimethyl-1-(4-methylphenyl)-5-propoxypyrazolidin-3-one (CAS 1226-64-8) is a chemical compound with molecular formula C15H22N2O2 and molecular weight 262.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,4-dimethyl-1-(4-methylphenyl)-5-propoxypyrazolidin-3-one
Also Known As: 4,4-dimethyl-1-(4-methylphenyl)-5-propoxypyrazolidin-3-one, 4,4-Dimethyl-5-propoxy-1-(p-tolyl)pyrazolidin-3-one, 4,4-dimethyl-5-propoxy-1-p-tolyl-pyrazolidin-3-one, 3-Pyrazolidinone,4,4-dimethyl-1-(4-methylphenyl)-5-propoxy-
| Molecular Formula | C15H22N2O2 |
|---|---|
| Molecular Weight | 262.17 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 41.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 262.16812 |
| Heavy Atoms | 19 |
| Complexity | 322.0 |
Chemical Identifiers
| CAS Number | 1226-64-8 |
|---|---|
| SMILES | CCCOC1C(C(=O)NN1C2=CC=C(C=C2)C)(C)C |
| InChIKey | PHEGOFFINWTBQQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4,4-Dimethyl-1-(4-methylphenyl)-5-propoxypyrazolidin-3-one (CAS 1226-64-8), with molecular formula C15H22N2O2 and molecular weight 262.17 g/mol. IUPAC: 4,4-dimethyl-1-(4-methylphenyl)-5-propoxypyrazolidin-3-one.
Chemical Property Profile of 4,4-Dimethyl-1-(4-methylphenyl)-5-propoxypyrazolidin-3-one
Property Insights of 4,4-Dimethyl-1-(4-methylphenyl)-5-propoxypyrazolidin-3-one
The XLogP value of 3.5 indicates that 4,4-Dimethyl-1-(4-methylphenyl)-5-propoxypyrazolidin-3-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.6 Ų, 4,4-Dimethyl-1-(4-methylphenyl)-5-propoxypyrazolidin-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,4-Dimethyl-1-(4-methylphenyl)-5-propoxypyrazolidin-3-one has 1 hydrogen bond donor(s) and 3 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 4,4-Dimethyl-1-(4-methylphenyl)-5-propoxypyrazolidin-3-one?
The CAS number of 4,4-Dimethyl-1-(4-methylphenyl)-5-propoxypyrazolidin-3-one is 1226-64-8.
What is the molecular formula of 4,4-Dimethyl-1-(4-methylphenyl)-5-propoxypyrazolidin-3-one?
The molecular formula of 4,4-Dimethyl-1-(4-methylphenyl)-5-propoxypyrazolidin-3-one is C15H22N2O2.
What is the molecular weight of 4,4-Dimethyl-1-(4-methylphenyl)-5-propoxypyrazolidin-3-one?
The molecular weight of 4,4-Dimethyl-1-(4-methylphenyl)-5-propoxypyrazolidin-3-one is 262.17 g/mol.
Where can I buy 4,4-Dimethyl-1-(4-methylphenyl)-5-propoxypyrazolidin-3-one?
You can request a quote for 4,4-Dimethyl-1-(4-methylphenyl)-5-propoxypyrazolidin-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,4-Dimethyl-1-(4-methylphenyl)-5-propoxypyrazolidin-3-one?
Yes, KEHONG BIO provides custom synthesis services for 4,4-Dimethyl-1-(4-methylphenyl)-5-propoxypyrazolidin-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.