![1-[4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl]-2-phenylbutan-1-one structure](/static/products/3495/349537-75-3.webp)
1-[4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl]-2-phenylbutan-1-one
TL;DR: 1-[4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl]-2-phenylbutan-1-one (CAS 349537-75-3) is a chemical compound with molecular formula C22H26N2O3 and molecular weight 366.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-phenylbutan-1-one
Also Known As: BAS 03034083, 1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-phenylbutan-1-one, 1-(4-(benzo[d][1,3]dioxol-5-ylmethyl)piperazin-1-yl)-2-phenylbutan-1-one, 1-(4-Benzo[1,3]dioxol-5-ylmethyl-piperazin-1-yl)-2-phenyl-butan-1-one, 1-[4-(2H-benzo[3,4-d]1,3-dioxolen-5-ylmethyl)piperazinyl]-2-phenylbutan-1-one
| Molecular Formula | C22H26N2O3 |
|---|---|
| Molecular Weight | 366.19 g/mol |
| LogP | 3.2533 |
| Topological Polar Surface Area | 42.01 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 366.19434 |
| Heavy Atoms | 27 |
| Complexity | 785.39984 |
Chemical Identifiers
| CAS Number | 349537-75-3 |
|---|---|
| SMILES | CCC(C1=CC=CC=C1)C(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4 |
Product Overview
1-[4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl]-2-phenylbutan-1-one (CAS 349537-75-3), with molecular formula C22H26N2O3 and molecular weight 366.19 g/mol. IUPAC: 1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-phenylbutan-1-one.
Chemical Property Profile of 1-[4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl]-2-phenylbutan-1-one
Property Insights of 1-[4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl]-2-phenylbutan-1-one
The XLogP value of 3.2533 indicates that 1-[4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl]-2-phenylbutan-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.01 Ų, 1-[4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl]-2-phenylbutan-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl]-2-phenylbutan-1-one 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 1-[4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl]-2-phenylbutan-1-one?
The CAS number of 1-[4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl]-2-phenylbutan-1-one is 349537-75-3.
What is the molecular formula of 1-[4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl]-2-phenylbutan-1-one?
The molecular formula of 1-[4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl]-2-phenylbutan-1-one is C22H26N2O3.
What is the molecular weight of 1-[4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl]-2-phenylbutan-1-one?
The molecular weight of 1-[4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl]-2-phenylbutan-1-one is 366.19 g/mol.
Where can I buy 1-[4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl]-2-phenylbutan-1-one?
You can request a quote for 1-[4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl]-2-phenylbutan-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-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl]-2-phenylbutan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 1-[4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl]-2-phenylbutan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.