2H,3H-benzo[e]1,4-dioxin-2-yl 4-ethylpiperazinyl ketone
TL;DR: 2H,3H-benzo[e]1,4-dioxin-2-yl 4-ethylpiperazinyl ketone (CAS 21867-88-9) is a chemical compound with molecular formula C15H20N2O3 and molecular weight 276.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3-dihydro-1,4-benzodioxin-3-yl-(4-ethylpiperazin-1-yl)methanone
Also Known As: 2H,3H-benzo[e]1,4-dioxin-2-yl 4-ethylpiperazinyl ketone, AS-871/41703884, 2,3-dihydro-1,4-benzodioxin-3-yl-(4-ethylpiperazin-1-yl)methanone, (2,3-dihydrobenzo[b][1,4]dioxin-2-yl)(4-ethylpiperazin-1-yl)methanone, 1-(2,3-dihydro-1,4-benzodioxin-2-ylcarbonyl)-4-ethylpiperazine
| Molecular Formula | C15H20N2O3 |
|---|---|
| Molecular Weight | 276.15 g/mol |
| LogP | 0.9905 |
| Topological Polar Surface Area | 42.01 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 276.1474 |
| Heavy Atoms | 20 |
| Complexity | 483.7619 |
Chemical Identifiers
| CAS Number | 21867-88-9 |
|---|---|
| SMILES | CCN1CCN(CC1)C(=O)C2COC3=CC=CC=C3O2 |
Product Overview
2H,3H-benzo[e]1,4-dioxin-2-yl 4-ethylpiperazinyl ketone (CAS 21867-88-9), with molecular formula C15H20N2O3 and molecular weight 276.15 g/mol. IUPAC: 2,3-dihydro-1,4-benzodioxin-3-yl-(4-ethylpiperazin-1-yl)methanone.
Chemical Property Profile of 2H,3H-benzo[e]1,4-dioxin-2-yl 4-ethylpiperazinyl ketone
Property Insights of 2H,3H-benzo[e]1,4-dioxin-2-yl 4-ethylpiperazinyl ketone
The XLogP value of 0.9905 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2H,3H-benzo[e]1,4-dioxin-2-yl 4-ethylpiperazinyl ketone. With a topological polar surface area (TPSA) of 42.01 Ų, 2H,3H-benzo[e]1,4-dioxin-2-yl 4-ethylpiperazinyl ketone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2H,3H-benzo[e]1,4-dioxin-2-yl 4-ethylpiperazinyl ketone 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 2H,3H-benzo[e]1,4-dioxin-2-yl 4-ethylpiperazinyl ketone?
The CAS number of 2H,3H-benzo[e]1,4-dioxin-2-yl 4-ethylpiperazinyl ketone is 21867-88-9.
What is the molecular formula of 2H,3H-benzo[e]1,4-dioxin-2-yl 4-ethylpiperazinyl ketone?
The molecular formula of 2H,3H-benzo[e]1,4-dioxin-2-yl 4-ethylpiperazinyl ketone is C15H20N2O3.
What is the molecular weight of 2H,3H-benzo[e]1,4-dioxin-2-yl 4-ethylpiperazinyl ketone?
The molecular weight of 2H,3H-benzo[e]1,4-dioxin-2-yl 4-ethylpiperazinyl ketone is 276.15 g/mol.
Where can I buy 2H,3H-benzo[e]1,4-dioxin-2-yl 4-ethylpiperazinyl ketone?
You can request a quote for 2H,3H-benzo[e]1,4-dioxin-2-yl 4-ethylpiperazinyl ketone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2H,3H-benzo[e]1,4-dioxin-2-yl 4-ethylpiperazinyl ketone?
Yes, KEHONG BIO provides custom synthesis services for 2H,3H-benzo[e]1,4-dioxin-2-yl 4-ethylpiperazinyl ketone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.