1,3-Indandione, 2-(4-(p-methoxyphenyl)-1-piperazinyl)-2-methyl-
TL;DR: 1,3-Indandione, 2-(4-(p-methoxyphenyl)-1-piperazinyl)-2-methyl- (CAS 17330-80-2) is a chemical compound with molecular formula C21H22N2O3 and molecular weight 350.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(4-methoxyphenyl)piperazin-1-yl]-2-methylindene-1,3-dione
Also Known As: 1,3-Indandione, 2-(4-(p-methoxyphenyl)-1-piperazinyl)-2-methyl-, 5-23-02-00235 (Beilstein Handbook Reference), 2-(4-(p-Methoxyphenyl)-1-piperazinyl)-2-methyl-1,3-indandione, 2-(4-p-methoxyphenyl-1-piperazinyl)-2-methyl-1,3-indanedion, 2-[4-(4-methoxyphenyl)piperazin-1-yl]-2-methylindene-1,3-dione
| Molecular Formula | C21H22N2O3 |
|---|---|
| Molecular Weight | 350.16 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 49.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 350.16306 |
| Heavy Atoms | 26 |
| Complexity | 523.0 |
Chemical Identifiers
| CAS Number | 17330-80-2 |
|---|---|
| SMILES | CC1(C(=O)C2=CC=CC=C2C1=O)N3CCN(CC3)C4=CC=C(C=C4)OC |
| InChIKey | JMRCCMVBTDIWCV-UHFFFAOYSA-N |
Product Overview
1,3-Indandione, 2-(4-(p-methoxyphenyl)-1-piperazinyl)-2-methyl- (CAS 17330-80-2), with molecular formula C21H22N2O3 and molecular weight 350.16 g/mol. IUPAC: 2-[4-(4-methoxyphenyl)piperazin-1-yl]-2-methylindene-1,3-dione.
Chemical Property Profile of 1,3-Indandione, 2-(4-(p-methoxyphenyl)-1-piperazinyl)-2-methyl-
Property Insights of 1,3-Indandione, 2-(4-(p-methoxyphenyl)-1-piperazinyl)-2-methyl-
The XLogP value of 3.3 indicates that 1,3-Indandione, 2-(4-(p-methoxyphenyl)-1-piperazinyl)-2-methyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.9 Ų, 1,3-Indandione, 2-(4-(p-methoxyphenyl)-1-piperazinyl)-2-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Indandione, 2-(4-(p-methoxyphenyl)-1-piperazinyl)-2-methyl- has 0 hydrogen bond donor(s) and 5 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 1,3-Indandione, 2-(4-(p-methoxyphenyl)-1-piperazinyl)-2-methyl-?
The CAS number of 1,3-Indandione, 2-(4-(p-methoxyphenyl)-1-piperazinyl)-2-methyl- is 17330-80-2.
What is the molecular formula of 1,3-Indandione, 2-(4-(p-methoxyphenyl)-1-piperazinyl)-2-methyl-?
The molecular formula of 1,3-Indandione, 2-(4-(p-methoxyphenyl)-1-piperazinyl)-2-methyl- is C21H22N2O3.
What is the molecular weight of 1,3-Indandione, 2-(4-(p-methoxyphenyl)-1-piperazinyl)-2-methyl-?
The molecular weight of 1,3-Indandione, 2-(4-(p-methoxyphenyl)-1-piperazinyl)-2-methyl- is 350.16 g/mol.
Where can I buy 1,3-Indandione, 2-(4-(p-methoxyphenyl)-1-piperazinyl)-2-methyl-?
You can request a quote for 1,3-Indandione, 2-(4-(p-methoxyphenyl)-1-piperazinyl)-2-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Indandione, 2-(4-(p-methoxyphenyl)-1-piperazinyl)-2-methyl-?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Indandione, 2-(4-(p-methoxyphenyl)-1-piperazinyl)-2-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.