Propiophenone, 4'-(isopentyloxy)-3-(4-phenyl-1-piperazinyl)-
TL;DR: Propiophenone, 4'-(isopentyloxy)-3-(4-phenyl-1-piperazinyl)- (CAS 55057-73-3) is a chemical compound with molecular formula C24H32N2O2 and molecular weight 380.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-(3-methylbutoxy)phenyl]-3-(4-phenylpiperazin-1-yl)propan-1-one
Also Known As: S-2[muscle relaxant], (+-)-Aeroplysinin I, AEROPLYSININ-I (RACEMIC), 1-[4- phenyl]-3-1-propanone, 1-[4- phenyl]-3- -1-propanone
| Molecular Formula | C24H32N2O2 |
|---|---|
| Molecular Weight | 380.25 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 32.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 380.24637 |
| Heavy Atoms | 28 |
| Complexity | 446.0 |
Chemical Identifiers
| CAS Number | 55057-73-3 |
|---|---|
| SMILES | CC(C)CCOC1=CC=C(C=C1)C(=O)CCN2CCN(CC2)C3=CC=CC=C3 |
| InChIKey | RSVVDYCQDDTRHH-UHFFFAOYSA-N |
Product Overview
Propiophenone, 4'-(isopentyloxy)-3-(4-phenyl-1-piperazinyl)- (CAS 55057-73-3), with molecular formula C24H32N2O2 and molecular weight 380.25 g/mol. IUPAC: 1-[4-(3-methylbutoxy)phenyl]-3-(4-phenylpiperazin-1-yl)propan-1-one.
Chemical Property Profile of Propiophenone, 4'-(isopentyloxy)-3-(4-phenyl-1-piperazinyl)-
Property Insights of Propiophenone, 4'-(isopentyloxy)-3-(4-phenyl-1-piperazinyl)-
The XLogP value of 4.8 indicates that Propiophenone, 4'-(isopentyloxy)-3-(4-phenyl-1-piperazinyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.8 Ų, Propiophenone, 4'-(isopentyloxy)-3-(4-phenyl-1-piperazinyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Propiophenone, 4'-(isopentyloxy)-3-(4-phenyl-1-piperazinyl)- has 0 hydrogen bond donor(s) and 4 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 Propiophenone, 4'-(isopentyloxy)-3-(4-phenyl-1-piperazinyl)-?
The CAS number of Propiophenone, 4'-(isopentyloxy)-3-(4-phenyl-1-piperazinyl)- is 55057-73-3.
What is the molecular formula of Propiophenone, 4'-(isopentyloxy)-3-(4-phenyl-1-piperazinyl)-?
The molecular formula of Propiophenone, 4'-(isopentyloxy)-3-(4-phenyl-1-piperazinyl)- is C24H32N2O2.
What is the molecular weight of Propiophenone, 4'-(isopentyloxy)-3-(4-phenyl-1-piperazinyl)-?
The molecular weight of Propiophenone, 4'-(isopentyloxy)-3-(4-phenyl-1-piperazinyl)- is 380.25 g/mol.
Where can I buy Propiophenone, 4'-(isopentyloxy)-3-(4-phenyl-1-piperazinyl)-?
You can request a quote for Propiophenone, 4'-(isopentyloxy)-3-(4-phenyl-1-piperazinyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propiophenone, 4'-(isopentyloxy)-3-(4-phenyl-1-piperazinyl)-?
Yes, KEHONG BIO provides custom synthesis services for Propiophenone, 4'-(isopentyloxy)-3-(4-phenyl-1-piperazinyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.