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2-[2-(1-Piperazinyl)ethyl]-1H-isoindole-1,3(2H)-dione
TL;DR: 2-[2-(1-Piperazinyl)ethyl]-1H-isoindole-1,3(2H)-dione (CAS 6820-93-5) is a chemical compound with molecular formula C14H17N3O2 and molecular weight 259.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-piperazin-1-ylethyl)isoindole-1,3-dione
Also Known As: 2-(2-(Piperazin-1-yl)ethyl)isoindoline-1,3-dione, 2-[2-(1-Piperazinyl)ethyl]-1H-isoindole-1,3(2H)-dione, 2-(2-Piperazin-1-yl-ethyl)-isoindole-1,3-dione, 2-(2-piperazin-1-ylethyl)isoindole-1,3-dione, 2-[2-(piperazin-1-yl)ethyl]-2,3-dihydro-1H-isoindole-1,3-dione
| Molecular Formula | C14H17N3O2 |
|---|---|
| Molecular Weight | 259.13 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 52.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 259.13208 |
| Heavy Atoms | 19 |
| Complexity | 342.0 |
Chemical Identifiers
| CAS Number | 6820-93-5 |
|---|---|
| SMILES | C1CN(CCN1)CCN2C(=O)C3=CC=CC=C3C2=O |
| InChIKey | RNVRPMJIWZILNQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-[2-(1-Piperazinyl)ethyl]-1H-isoindole-1,3(2H)-dione (CAS 6820-93-5), with molecular formula C14H17N3O2 and molecular weight 259.13 g/mol. IUPAC: 2-(2-piperazin-1-ylethyl)isoindole-1,3-dione.
Chemical Property Profile of 2-[2-(1-Piperazinyl)ethyl]-1H-isoindole-1,3(2H)-dione
Property Insights of 2-[2-(1-Piperazinyl)ethyl]-1H-isoindole-1,3(2H)-dione
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[2-(1-Piperazinyl)ethyl]-1H-isoindole-1,3(2H)-dione. With a topological polar surface area (TPSA) of 52.7 Ų, 2-[2-(1-Piperazinyl)ethyl]-1H-isoindole-1,3(2H)-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[2-(1-Piperazinyl)ethyl]-1H-isoindole-1,3(2H)-dione has 1 hydrogen bond donor(s) and 4 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-[2-(1-Piperazinyl)ethyl]-1H-isoindole-1,3(2H)-dione?
The CAS number of 2-[2-(1-Piperazinyl)ethyl]-1H-isoindole-1,3(2H)-dione is 6820-93-5.
What is the molecular formula of 2-[2-(1-Piperazinyl)ethyl]-1H-isoindole-1,3(2H)-dione?
The molecular formula of 2-[2-(1-Piperazinyl)ethyl]-1H-isoindole-1,3(2H)-dione is C14H17N3O2.
What is the molecular weight of 2-[2-(1-Piperazinyl)ethyl]-1H-isoindole-1,3(2H)-dione?
The molecular weight of 2-[2-(1-Piperazinyl)ethyl]-1H-isoindole-1,3(2H)-dione is 259.13 g/mol.
Where can I buy 2-[2-(1-Piperazinyl)ethyl]-1H-isoindole-1,3(2H)-dione?
You can request a quote for 2-[2-(1-Piperazinyl)ethyl]-1H-isoindole-1,3(2H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[2-(1-Piperazinyl)ethyl]-1H-isoindole-1,3(2H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-[2-(1-Piperazinyl)ethyl]-1H-isoindole-1,3(2H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.