4-Amino-2-o-tolylisoindole-1,3-dione
TL;DR: 4-Amino-2-o-tolylisoindole-1,3-dione (CAS 108620-87-7) is a chemical compound with molecular formula C15H12N2O2 and molecular weight 252.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-amino-2-(2-methylphenyl)isoindole-1,3-dione
Also Known As: 4-Amino-2-o-tolylisoindole-1,3-dione, 4-Amino-2-(o-tolyl)isoindoline-1,3-dione, 4-Amino-2-o-tolyl-isoindole-1,3-dione, 4-amino-2-(2-methylphenyl)isoindole-1,3-dione, BAS 00135786
| Molecular Formula | C15H12N2O2 |
|---|---|
| Molecular Weight | 252.09 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 63.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 252.08987 |
| Heavy Atoms | 19 |
| Complexity | 396.0 |
Chemical Identifiers
| CAS Number | 108620-87-7 |
|---|---|
| SMILES | CC1=CC=CC=C1N2C(=O)C3=C(C2=O)C(=CC=C3)N |
| InChIKey | VYOFXWMSERJQPA-UHFFFAOYSA-N |
Product Overview
4-Amino-2-o-tolylisoindole-1,3-dione (CAS 108620-87-7), with molecular formula C15H12N2O2 and molecular weight 252.09 g/mol. IUPAC: 4-amino-2-(2-methylphenyl)isoindole-1,3-dione.
Chemical Property Profile of 4-Amino-2-o-tolylisoindole-1,3-dione
Property Insights of 4-Amino-2-o-tolylisoindole-1,3-dione
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Amino-2-o-tolylisoindole-1,3-dione. The TPSA of 63.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Amino-2-o-tolylisoindole-1,3-dione. Following Lipinski's Rule of Five, 4-Amino-2-o-tolylisoindole-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 4-Amino-2-o-tolylisoindole-1,3-dione?
The CAS number of 4-Amino-2-o-tolylisoindole-1,3-dione is 108620-87-7.
What is the molecular formula of 4-Amino-2-o-tolylisoindole-1,3-dione?
The molecular formula of 4-Amino-2-o-tolylisoindole-1,3-dione is C15H12N2O2.
What is the molecular weight of 4-Amino-2-o-tolylisoindole-1,3-dione?
The molecular weight of 4-Amino-2-o-tolylisoindole-1,3-dione is 252.09 g/mol.
Where can I buy 4-Amino-2-o-tolylisoindole-1,3-dione?
You can request a quote for 4-Amino-2-o-tolylisoindole-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 4-Amino-2-o-tolylisoindole-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 4-Amino-2-o-tolylisoindole-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.