5-Amino-2-(tert-butyl)isoindoline-1,3-dione
TL;DR: 5-Amino-2-(tert-butyl)isoindoline-1,3-dione (CAS 56131-19-2) is a chemical compound with molecular formula C12H14N2O2 and molecular weight 218.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-amino-2-tert-butylisoindole-1,3-dione
Also Known As: 5-Amino-2-(tert-butyl)isoindoline-1,3-dione, 5-amino-2-tert-butylisoindole-1,3-dione, 4-amino-N-tertbutylphthalimide, 4-Amino-N-tert-butylphthalimide, 5-amino-2-tert-butyl-isoindole-1,3-dione
| Molecular Formula | C12H14N2O2 |
|---|---|
| Molecular Weight | 218.11 g/mol |
| LogP | 1.6633 |
| Topological Polar Surface Area | 63.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 218.10553 |
| Heavy Atoms | 16 |
| Complexity | 486.2824 |
Chemical Identifiers
| CAS Number | 56131-19-2 |
|---|---|
| SMILES | CC(C)(C)N1C(=O)C2=C(C1=O)C=C(C=C2)N |
Product Overview
5-Amino-2-(tert-butyl)isoindoline-1,3-dione (CAS 56131-19-2), with molecular formula C12H14N2O2 and molecular weight 218.11 g/mol. IUPAC: 5-amino-2-tert-butylisoindole-1,3-dione.
Chemical Property Profile of 5-Amino-2-(tert-butyl)isoindoline-1,3-dione
Property Insights of 5-Amino-2-(tert-butyl)isoindoline-1,3-dione
The XLogP value of 1.6633 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Amino-2-(tert-butyl)isoindoline-1,3-dione. The TPSA of 63.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Amino-2-(tert-butyl)isoindoline-1,3-dione. Following Lipinski's Rule of Five, 5-Amino-2-(tert-butyl)isoindoline-1,3-dione has 1 hydrogen bond donor(s) and 3 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 5-Amino-2-(tert-butyl)isoindoline-1,3-dione?
The CAS number of 5-Amino-2-(tert-butyl)isoindoline-1,3-dione is 56131-19-2.
What is the molecular formula of 5-Amino-2-(tert-butyl)isoindoline-1,3-dione?
The molecular formula of 5-Amino-2-(tert-butyl)isoindoline-1,3-dione is C12H14N2O2.
What is the molecular weight of 5-Amino-2-(tert-butyl)isoindoline-1,3-dione?
The molecular weight of 5-Amino-2-(tert-butyl)isoindoline-1,3-dione is 218.11 g/mol.
Where can I buy 5-Amino-2-(tert-butyl)isoindoline-1,3-dione?
You can request a quote for 5-Amino-2-(tert-butyl)isoindoline-1,3-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Amino-2-(tert-butyl)isoindoline-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 5-Amino-2-(tert-butyl)isoindoline-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.