methanone structure](/static/products/5878/58782-36-8.webp)
[4-(4-Methylbenzyl)piperazin-1-yl](phenyl)methanone
TL;DR: [4-(4-Methylbenzyl)piperazin-1-yl](phenyl)methanone (CAS 58782-36-8) is a chemical compound with molecular formula C19H22N2O and molecular weight 294.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[(4-methylphenyl)methyl]piperazin-1-yl]-phenylmethanone
Also Known As: 3-(4-methyl-thiophen-2-yl)-acrylic acid, [4-(4-methylbenzyl)piperazin-1-yl](phenyl)methanone, [4-[(4-methylphenyl)methyl]piperazin-1-yl]-phenylmethanone, 1-benzoyl-4-[(4-methylphenyl)methyl]piperazine, AB00098577-01
| Molecular Formula | C19H22N2O |
|---|---|
| Molecular Weight | 294.17 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 23.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 294.17322 |
| Heavy Atoms | 22 |
| Complexity | 348.0 |
Chemical Identifiers
| CAS Number | 58782-36-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CN2CCN(CC2)C(=O)C3=CC=CC=C3 |
| InChIKey | BNTHNHKCFISDNB-UHFFFAOYSA-N |
Product Overview
[4-(4-Methylbenzyl)piperazin-1-yl](phenyl)methanone (CAS 58782-36-8), with molecular formula C19H22N2O and molecular weight 294.17 g/mol. IUPAC: [4-[(4-methylphenyl)methyl]piperazin-1-yl]-phenylmethanone.
Chemical Property Profile of [4-(4-Methylbenzyl)piperazin-1-yl](phenyl)methanone
Property Insights of [4-(4-Methylbenzyl)piperazin-1-yl](phenyl)methanone
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [4-(4-Methylbenzyl)piperazin-1-yl](phenyl)methanone. With a topological polar surface area (TPSA) of 23.6 Ų, [4-(4-Methylbenzyl)piperazin-1-yl](phenyl)methanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [4-(4-Methylbenzyl)piperazin-1-yl](phenyl)methanone has 0 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 [4-(4-Methylbenzyl)piperazin-1-yl](phenyl)methanone?
The CAS number of [4-(4-Methylbenzyl)piperazin-1-yl](phenyl)methanone is 58782-36-8.
What is the molecular formula of [4-(4-Methylbenzyl)piperazin-1-yl](phenyl)methanone?
The molecular formula of [4-(4-Methylbenzyl)piperazin-1-yl](phenyl)methanone is C19H22N2O.
What is the molecular weight of [4-(4-Methylbenzyl)piperazin-1-yl](phenyl)methanone?
The molecular weight of [4-(4-Methylbenzyl)piperazin-1-yl](phenyl)methanone is 294.17 g/mol.
Where can I buy [4-(4-Methylbenzyl)piperazin-1-yl](phenyl)methanone?
You can request a quote for [4-(4-Methylbenzyl)piperazin-1-yl](phenyl)methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [4-(4-Methylbenzyl)piperazin-1-yl](phenyl)methanone?
Yes, KEHONG BIO provides custom synthesis services for [4-(4-Methylbenzyl)piperazin-1-yl](phenyl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.