2-(1H-indol-3-yl)-1-(4-methylpiperazin-1-yl)ethanone
TL;DR: 2-(1H-indol-3-yl)-1-(4-methylpiperazin-1-yl)ethanone (CAS 58106-90-4) is a chemical compound with molecular formula C15H19N3O and molecular weight 257.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1H-indol-3-yl)-1-(4-methylpiperazin-1-yl)ethanone
Also Known As: 2-(1H-indol-3-yl)-1-(4-methylpiperazin-1-yl)ethanone, Piperazine, 1-(1H-indol-3-ylacetyl)-4-methyl-, 2-(1H-Indol-3-yl)-1-(4-methylpiperazin-1-yl)ethan-1-one, ETHANONE,2-(1H-INDOL-3-YL)-1-(4-METHYL-1-PIPERAZINYL)-
| Molecular Formula | C15H19N3O |
|---|---|
| Molecular Weight | 257.15 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 39.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 257.1528 |
| Heavy Atoms | 19 |
| Complexity | 325.0 |
Chemical Identifiers
| CAS Number | 58106-90-4 |
|---|---|
| SMILES | CN1CCN(CC1)C(=O)CC2=CNC3=CC=CC=C32 |
| InChIKey | WBNHPABRPNXDCI-UHFFFAOYSA-N |
Product Overview
2-(1H-indol-3-yl)-1-(4-methylpiperazin-1-yl)ethanone (CAS 58106-90-4), with molecular formula C15H19N3O and molecular weight 257.15 g/mol. IUPAC: 2-(1H-indol-3-yl)-1-(4-methylpiperazin-1-yl)ethanone.
Chemical Property Profile of 2-(1H-indol-3-yl)-1-(4-methylpiperazin-1-yl)ethanone
Property Insights of 2-(1H-indol-3-yl)-1-(4-methylpiperazin-1-yl)ethanone
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(1H-indol-3-yl)-1-(4-methylpiperazin-1-yl)ethanone. With a topological polar surface area (TPSA) of 39.3 Ų, 2-(1H-indol-3-yl)-1-(4-methylpiperazin-1-yl)ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(1H-indol-3-yl)-1-(4-methylpiperazin-1-yl)ethanone has 1 hydrogen bond donor(s) and 2 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 2-(1H-indol-3-yl)-1-(4-methylpiperazin-1-yl)ethanone?
The CAS number of 2-(1H-indol-3-yl)-1-(4-methylpiperazin-1-yl)ethanone is 58106-90-4.
What is the molecular formula of 2-(1H-indol-3-yl)-1-(4-methylpiperazin-1-yl)ethanone?
The molecular formula of 2-(1H-indol-3-yl)-1-(4-methylpiperazin-1-yl)ethanone is C15H19N3O.
What is the molecular weight of 2-(1H-indol-3-yl)-1-(4-methylpiperazin-1-yl)ethanone?
The molecular weight of 2-(1H-indol-3-yl)-1-(4-methylpiperazin-1-yl)ethanone is 257.15 g/mol.
Where can I buy 2-(1H-indol-3-yl)-1-(4-methylpiperazin-1-yl)ethanone?
You can request a quote for 2-(1H-indol-3-yl)-1-(4-methylpiperazin-1-yl)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1H-indol-3-yl)-1-(4-methylpiperazin-1-yl)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 2-(1H-indol-3-yl)-1-(4-methylpiperazin-1-yl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.