1-(4-Chlorophenyl)-3-(4-methyl-1-piperazinyl)-2-propyn-1-one
TL;DR: 1-(4-Chlorophenyl)-3-(4-methyl-1-piperazinyl)-2-propyn-1-one (CAS 67543-09-3) is a chemical compound with molecular formula C14H15ClN2O and molecular weight 262.08728 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(4-chlorophenyl)-3-(4-methylpiperazin-1-yl)prop-2-yn-1-one
Also Known As: KST-1B7430, 1-(4-Chlorophenyl)-3-(4-methyl-1-piperazinyl)-2-propyn-1-one, 1-(4-chlorophenyl)-3-(4-methylpiperazin-1-yl)prop-2-yn-1-one, 2-Propyn-1-one, 1-(4-chlorophenyl)-3-(4-methyl-1-piperazinyl)-, 1-(4-CHLOROPHENYL)-3-(4-METHYL-(PIPERAZIN-1-YL))-2-PROPYN-1-ONE
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C14H15ClN2O |
| Molecular Weight | 262.08728 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 23.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 262.08728 Da |
| Heavy Atoms | 18 |
| Complexity | 354.0 |
| SMILES | CN1CCN(CC1)C#CC(=O)C2=CC=C(C=C2)Cl |
| InChIKey | LAIWMWXJMJXQPE-UHFFFAOYSA-N |
Chemical Property Profile of 1-(4-Chlorophenyl)-3-(4-methyl-1-piperazinyl)-2-propyn-1-one
Property Insights of 1-(4-Chlorophenyl)-3-(4-methyl-1-piperazinyl)-2-propyn-1-one
The XLogP value of 3.0 indicates that 1-(4-Chlorophenyl)-3-(4-methyl-1-piperazinyl)-2-propyn-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.6 Ų, 1-(4-Chlorophenyl)-3-(4-methyl-1-piperazinyl)-2-propyn-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Chlorophenyl)-3-(4-methyl-1-piperazinyl)-2-propyn-1-one has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-(4-Chlorophenyl)-3-(4-methyl-1-piperazinyl)-2-propyn-1-one?
The CAS number of 1-(4-Chlorophenyl)-3-(4-methyl-1-piperazinyl)-2-propyn-1-one is 67543-09-3.
What is the molecular formula of 1-(4-Chlorophenyl)-3-(4-methyl-1-piperazinyl)-2-propyn-1-one?
The molecular formula of 1-(4-Chlorophenyl)-3-(4-methyl-1-piperazinyl)-2-propyn-1-one is C14H15ClN2O.
What is the molecular weight of 1-(4-Chlorophenyl)-3-(4-methyl-1-piperazinyl)-2-propyn-1-one?
The molecular weight of 1-(4-Chlorophenyl)-3-(4-methyl-1-piperazinyl)-2-propyn-1-one is 262.08728 g/mol.
Where can I buy 1-(4-Chlorophenyl)-3-(4-methyl-1-piperazinyl)-2-propyn-1-one?
You can request a quote for 1-(4-Chlorophenyl)-3-(4-methyl-1-piperazinyl)-2-propyn-1-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(4-Chlorophenyl)-3-(4-methyl-1-piperazinyl)-2-propyn-1-one?
Yes, CoreyChem provides custom synthesis services for 1-(4-Chlorophenyl)-3-(4-methyl-1-piperazinyl)-2-propyn-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.