1,3-Dioxo-alpha-isopropyl-2H-isoindoline-2-acetic acid piperazine (salt)
TL;DR: 1,3-Dioxo-alpha-isopropyl-2H-isoindoline-2-acetic acid piperazine (salt) (CAS 58248-08-1) is a chemical compound with molecular formula C30H36N4O8 and molecular weight 580.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(2-(1,3-dioxoisoindol-2-yl)-3-methylbutanoic acid);piperazine
Also Known As: 1,3-Dioxo-alpha-isopropyl-2H-isoindoline-2-acetic acid piperazine (salt), 2-(1,3-dioxoisoindol-2-yl)-3-methylbutanoic acid; piperazine, 2-(1,3-Dioxo-1,3-dihydro-2H-isoindol-2-yl)-3-methylbutanoic acid--piperazine (2/1), 2H-Isoindole-2-acetic acid, 1,3-dihydro-alpha-(1-methylethyl)-1,3-dioxo-, compd. with piperazine (2:1), RefChem:1060614
| Molecular Formula | C30H36N4O8 |
|---|---|
| Molecular Weight | 580.25 g/mol |
| LogP | 1.9628 |
| Topological Polar Surface Area | 173.42 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 580.2533 |
| Heavy Atoms | 42 |
| Complexity | 1189.5728 |
Chemical Identifiers
| CAS Number | 58248-08-1 |
|---|---|
| SMILES | CC(C)C(C(=O)O)N1C(=O)C2=CC=CC=C2C1=O.CC(C)C(C(=O)O)N1C(=O)C2=CC=CC=C2C1=O.C1CNCCN1 |
Product Overview
1,3-Dioxo-alpha-isopropyl-2H-isoindoline-2-acetic acid piperazine (salt) (CAS 58248-08-1), with molecular formula C30H36N4O8 and molecular weight 580.25 g/mol. IUPAC: bis(2-(1,3-dioxoisoindol-2-yl)-3-methylbutanoic acid);piperazine.
Chemical Property Profile of 1,3-Dioxo-alpha-isopropyl-2H-isoindoline-2-acetic acid piperazine (salt)
Property Insights of 1,3-Dioxo-alpha-isopropyl-2H-isoindoline-2-acetic acid piperazine (salt)
The XLogP value of 1.9628 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Dioxo-alpha-isopropyl-2H-isoindoline-2-acetic acid piperazine (salt). The TPSA of 173.42 Ų indicates high polarity, suggesting 1,3-Dioxo-alpha-isopropyl-2H-isoindoline-2-acetic acid piperazine (salt) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1,3-Dioxo-alpha-isopropyl-2H-isoindoline-2-acetic acid piperazine (salt) has 4 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,3-Dioxo-alpha-isopropyl-2H-isoindoline-2-acetic acid piperazine (salt)?
The CAS number of 1,3-Dioxo-alpha-isopropyl-2H-isoindoline-2-acetic acid piperazine (salt) is 58248-08-1.
What is the molecular formula of 1,3-Dioxo-alpha-isopropyl-2H-isoindoline-2-acetic acid piperazine (salt)?
The molecular formula of 1,3-Dioxo-alpha-isopropyl-2H-isoindoline-2-acetic acid piperazine (salt) is C30H36N4O8.
What is the molecular weight of 1,3-Dioxo-alpha-isopropyl-2H-isoindoline-2-acetic acid piperazine (salt)?
The molecular weight of 1,3-Dioxo-alpha-isopropyl-2H-isoindoline-2-acetic acid piperazine (salt) is 580.25 g/mol.
Where can I buy 1,3-Dioxo-alpha-isopropyl-2H-isoindoline-2-acetic acid piperazine (salt)?
You can request a quote for 1,3-Dioxo-alpha-isopropyl-2H-isoindoline-2-acetic acid piperazine (salt) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Dioxo-alpha-isopropyl-2H-isoindoline-2-acetic acid piperazine (salt)?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Dioxo-alpha-isopropyl-2H-isoindoline-2-acetic acid piperazine (salt) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.