![3-{[4-(4-methylbenzyl)piperazin-1-yl]methyl}-1H-indole structure](/static/products/3560/356085-10-4.webp)
3-{[4-(4-methylbenzyl)piperazin-1-yl]methyl}-1H-indole
TL;DR: 3-{[4-(4-methylbenzyl)piperazin-1-yl]methyl}-1H-indole (CAS 356085-10-4) is a chemical compound with molecular formula C21H25N3 and molecular weight 319.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[4-[(4-methylphenyl)methyl]piperazin-1-yl]methyl]-1H-indole
Also Known As: BIM-0036810.P001, 3-{[4-(4-methylbenzyl)piperazin-1-yl]methyl}-1H-indole, AB00099711-01, 3-[[4-[(4-Methylphenyl)methyl]-1-piperazinyl]methyl]-1H-indole, 3-{[4-(4-methylbenzyl)-1-piperazinyl]methyl}-1H-indole
| Molecular Formula | C21H25N3 |
|---|---|
| Molecular Weight | 319.20 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 22.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 319.20483 |
| Heavy Atoms | 24 |
| Complexity | 383.0 |
Chemical Identifiers
| CAS Number | 356085-10-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CN2CCN(CC2)CC3=CNC4=CC=CC=C43 |
| InChIKey | LEGQADSDIOYPOS-UHFFFAOYSA-N |
Product Overview
3-{[4-(4-methylbenzyl)piperazin-1-yl]methyl}-1H-indole (CAS 356085-10-4), with molecular formula C21H25N3 and molecular weight 319.20 g/mol. IUPAC: 3-[[4-[(4-methylphenyl)methyl]piperazin-1-yl]methyl]-1H-indole.
Chemical Property Profile of 3-{[4-(4-methylbenzyl)piperazin-1-yl]methyl}-1H-indole
Property Insights of 3-{[4-(4-methylbenzyl)piperazin-1-yl]methyl}-1H-indole
The XLogP value of 3.5 indicates that 3-{[4-(4-methylbenzyl)piperazin-1-yl]methyl}-1H-indole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 22.3 Ų, 3-{[4-(4-methylbenzyl)piperazin-1-yl]methyl}-1H-indole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-{[4-(4-methylbenzyl)piperazin-1-yl]methyl}-1H-indole 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 3-{[4-(4-methylbenzyl)piperazin-1-yl]methyl}-1H-indole?
The CAS number of 3-{[4-(4-methylbenzyl)piperazin-1-yl]methyl}-1H-indole is 356085-10-4.
What is the molecular formula of 3-{[4-(4-methylbenzyl)piperazin-1-yl]methyl}-1H-indole?
The molecular formula of 3-{[4-(4-methylbenzyl)piperazin-1-yl]methyl}-1H-indole is C21H25N3.
What is the molecular weight of 3-{[4-(4-methylbenzyl)piperazin-1-yl]methyl}-1H-indole?
The molecular weight of 3-{[4-(4-methylbenzyl)piperazin-1-yl]methyl}-1H-indole is 319.20 g/mol.
Where can I buy 3-{[4-(4-methylbenzyl)piperazin-1-yl]methyl}-1H-indole?
You can request a quote for 3-{[4-(4-methylbenzyl)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-(4-methylbenzyl)piperazin-1-yl]methyl}-1H-indole?
Yes, KEHONG BIO provides custom synthesis services for 3-{[4-(4-methylbenzyl)piperazin-1-yl]methyl}-1H-indole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.