![3-{[4-(methylsulfonyl)piperazin-1-yl]methyl}-1H-indole structure](/static/products/492/492429-75-1.png)
3-{[4-(methylsulfonyl)piperazin-1-yl]methyl}-1H-indole
TL;DR: 3-{[4-(methylsulfonyl)piperazin-1-yl]methyl}-1H-indole (CAS 492429-75-1) is a chemical compound with molecular formula C14H19N3O2S and molecular weight 293.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(4-methylsulfonylpiperazin-1-yl)methyl]-1H-indole
Also Known As: BAS 03050348, 3-(4-Methanesulfonyl-piperazin-1-ylmethyl)-1H-indole, BIM-0019353.P001, 3-{[4-(methylsulfonyl)piperazin-1-yl]methyl}-1H-indole, 3-[(4-methylsulfonylpiperazin-1-yl)methyl]-1H-indole
| Molecular Formula | C14H19N3O2S |
|---|---|
| Molecular Weight | 293.12 g/mol |
| LogP | 1.2451 |
| Topological Polar Surface Area | 56.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 293.1198 |
| Heavy Atoms | 20 |
| Complexity | 700.0322 |
Chemical Identifiers
| CAS Number | 492429-75-1 |
|---|---|
| SMILES | CS(=O)(=O)N1CCN(CC1)CC2=CNC3=CC=CC=C32 |
Product Overview
3-{[4-(methylsulfonyl)piperazin-1-yl]methyl}-1H-indole (CAS 492429-75-1), with molecular formula C14H19N3O2S and molecular weight 293.12 g/mol. IUPAC: 3-[(4-methylsulfonylpiperazin-1-yl)methyl]-1H-indole.
Chemical Property Profile of 3-{[4-(methylsulfonyl)piperazin-1-yl]methyl}-1H-indole
Property Insights of 3-{[4-(methylsulfonyl)piperazin-1-yl]methyl}-1H-indole
The XLogP value of 1.2451 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-{[4-(methylsulfonyl)piperazin-1-yl]methyl}-1H-indole. With a topological polar surface area (TPSA) of 56.41 Ų, 3-{[4-(methylsulfonyl)piperazin-1-yl]methyl}-1H-indole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-{[4-(methylsulfonyl)piperazin-1-yl]methyl}-1H-indole has 1 hydrogen bond donor(s) and 3 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 3-{[4-(methylsulfonyl)piperazin-1-yl]methyl}-1H-indole?
The CAS number of 3-{[4-(methylsulfonyl)piperazin-1-yl]methyl}-1H-indole is 492429-75-1.
What is the molecular formula of 3-{[4-(methylsulfonyl)piperazin-1-yl]methyl}-1H-indole?
The molecular formula of 3-{[4-(methylsulfonyl)piperazin-1-yl]methyl}-1H-indole is C14H19N3O2S.
What is the molecular weight of 3-{[4-(methylsulfonyl)piperazin-1-yl]methyl}-1H-indole?
The molecular weight of 3-{[4-(methylsulfonyl)piperazin-1-yl]methyl}-1H-indole is 293.12 g/mol.
Where can I buy 3-{[4-(methylsulfonyl)piperazin-1-yl]methyl}-1H-indole?
You can request a quote for 3-{[4-(methylsulfonyl)piperazin-1-yl]methyl}-1H-indole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-{[4-(methylsulfonyl)piperazin-1-yl]methyl}-1H-indole?
Yes, KEHONG BIO provides custom synthesis services for 3-{[4-(methylsulfonyl)piperazin-1-yl]methyl}-1H-indole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.