![1-[4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl]-2-chloroethanone structure](/static/products/3874/38740-33-9.webp)
1-[4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl]-2-chloroethanone
TL;DR: 1-[4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl]-2-chloroethanone (CAS 38740-33-9) is a chemical compound with molecular formula C14H17ClN2O3 and molecular weight 296.09 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-chloroethanone
Also Known As: UPCMLD0ENAT5441945:001, 2-chloro-1-(4-piperonylpiperazin-1-yl)ethanone, 2-ISOPROPYLSULFANYL-PYRIMIDINE-4-CARBALDEHYDE, 1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-chloroethanone, 1-[4-(benzo[1,3]dioxol-5-ylmethyl)piperazin-1-yl]-2-chloro-ethanone
| Molecular Formula | C14H17ClN2O3 |
|---|---|
| Molecular Weight | 296.09 g/mol |
| LogP | 1.2983 |
| Topological Polar Surface Area | 42.01 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 296.09277 |
| Heavy Atoms | 20 |
| Complexity | 501.1924 |
Chemical Identifiers
| CAS Number | 38740-33-9 |
|---|---|
| SMILES | C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)CCl |
Product Overview
1-[4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl]-2-chloroethanone (CAS 38740-33-9), with molecular formula C14H17ClN2O3 and molecular weight 296.09 g/mol. IUPAC: 1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-chloroethanone.
Chemical Property Profile of 1-[4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl]-2-chloroethanone
Property Insights of 1-[4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl]-2-chloroethanone
The XLogP value of 1.2983 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl]-2-chloroethanone. With a topological polar surface area (TPSA) of 42.01 Ų, 1-[4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl]-2-chloroethanone 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-chloroethanone 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-chloroethanone?
The CAS number of 1-[4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl]-2-chloroethanone is 38740-33-9.
What is the molecular formula of 1-[4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl]-2-chloroethanone?
The molecular formula of 1-[4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl]-2-chloroethanone is C14H17ClN2O3.
What is the molecular weight of 1-[4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl]-2-chloroethanone?
The molecular weight of 1-[4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl]-2-chloroethanone is 296.09 g/mol.
Where can I buy 1-[4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl]-2-chloroethanone?
You can request a quote for 1-[4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl]-2-chloroethanone 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-chloroethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-[4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl]-2-chloroethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.