1-(4-Phenyl-1-piperazinyl)-3-(1-pyrrolidinyl)-2-buten-1-one
TL;DR: 1-(4-Phenyl-1-piperazinyl)-3-(1-pyrrolidinyl)-2-buten-1-one (CAS 338408-99-4) is a chemical compound with molecular formula C18H25N3O and molecular weight 299.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-phenylpiperazin-1-yl)-3-pyrrolidin-1-ylbut-2-en-1-one
Also Known As: 1-(4-phenylpiperazino)-3-(1-pyrrolidinyl)-2-buten-1-one, 1-(4-Phenyl-1-piperazinyl)-3-(1-pyrrolidinyl)-2-buten-1-one, 1-(4-phenylpiperazin-1-yl)-3-pyrrolidin-1-ylbut-2-en-1-one, 1-(4-PHENYLPIPERAZIN-1-YL)-3-(PYRROLIDIN-1-YL)BUT-2-EN-1-ONE
| Molecular Formula | C18H25N3O |
|---|---|
| Molecular Weight | 299.20 g/mol |
| LogP | 2.3348 |
| Topological Polar Surface Area | 26.79 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 299.19977 |
| Heavy Atoms | 22 |
| Complexity | 526.5231 |
Chemical Identifiers
| CAS Number | 338408-99-4 |
|---|---|
| SMILES | CC(=CC(=O)N1CCN(CC1)C2=CC=CC=C2)N3CCCC3 |
Product Overview
1-(4-Phenyl-1-piperazinyl)-3-(1-pyrrolidinyl)-2-buten-1-one (CAS 338408-99-4), with molecular formula C18H25N3O and molecular weight 299.20 g/mol. IUPAC: 1-(4-phenylpiperazin-1-yl)-3-pyrrolidin-1-ylbut-2-en-1-one.
Chemical Property Profile of 1-(4-Phenyl-1-piperazinyl)-3-(1-pyrrolidinyl)-2-buten-1-one
Property Insights of 1-(4-Phenyl-1-piperazinyl)-3-(1-pyrrolidinyl)-2-buten-1-one
The XLogP value of 2.3348 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Phenyl-1-piperazinyl)-3-(1-pyrrolidinyl)-2-buten-1-one. With a topological polar surface area (TPSA) of 26.79 Ų, 1-(4-Phenyl-1-piperazinyl)-3-(1-pyrrolidinyl)-2-buten-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Phenyl-1-piperazinyl)-3-(1-pyrrolidinyl)-2-buten-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
Frequently Asked Questions
What is the CAS number of 1-(4-Phenyl-1-piperazinyl)-3-(1-pyrrolidinyl)-2-buten-1-one?
The CAS number of 1-(4-Phenyl-1-piperazinyl)-3-(1-pyrrolidinyl)-2-buten-1-one is 338408-99-4.
What is the molecular formula of 1-(4-Phenyl-1-piperazinyl)-3-(1-pyrrolidinyl)-2-buten-1-one?
The molecular formula of 1-(4-Phenyl-1-piperazinyl)-3-(1-pyrrolidinyl)-2-buten-1-one is C18H25N3O.
What is the molecular weight of 1-(4-Phenyl-1-piperazinyl)-3-(1-pyrrolidinyl)-2-buten-1-one?
The molecular weight of 1-(4-Phenyl-1-piperazinyl)-3-(1-pyrrolidinyl)-2-buten-1-one is 299.20 g/mol.
Where can I buy 1-(4-Phenyl-1-piperazinyl)-3-(1-pyrrolidinyl)-2-buten-1-one?
You can request a quote for 1-(4-Phenyl-1-piperazinyl)-3-(1-pyrrolidinyl)-2-buten-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Phenyl-1-piperazinyl)-3-(1-pyrrolidinyl)-2-buten-1-one?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Phenyl-1-piperazinyl)-3-(1-pyrrolidinyl)-2-buten-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.