![2-[[(4-Methylphenyl)amino]methyl]-1H-isoindole-1,3(2H)-dione structure](/static/products/3081/30818-66-7.webp)
2-[[(4-Methylphenyl)amino]methyl]-1H-isoindole-1,3(2H)-dione
TL;DR: 2-[[(4-Methylphenyl)amino]methyl]-1H-isoindole-1,3(2H)-dione (CAS 30818-66-7) is a chemical compound with molecular formula C16H14N2O2 and molecular weight 266.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-methylanilino)methyl]isoindole-1,3-dione
Also Known As: 2-[(4-methylanilino)methyl]isoindole-1,3-dione, BAS 00315950, 2-(4-Toluidinomethyl)-1H-isoindole-1,3(2H)-dione, 2-(p-Tolylamino-methyl)-isoindole-1,3-dione, 2-[[(4-Methylphenyl)amino]methyl]-1H-isoindole-1,3(2H)-dione
| Molecular Formula | C16H14N2O2 |
|---|---|
| Molecular Weight | 266.11 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 49.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 266.10553 |
| Heavy Atoms | 20 |
| Complexity | 364.0 |
Chemical Identifiers
| CAS Number | 30818-66-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NCN2C(=O)C3=CC=CC=C3C2=O |
| InChIKey | PJRYJXNGQASRBP-UHFFFAOYSA-N |
Product Overview
2-[[(4-Methylphenyl)amino]methyl]-1H-isoindole-1,3(2H)-dione (CAS 30818-66-7), with molecular formula C16H14N2O2 and molecular weight 266.11 g/mol. IUPAC: 2-[(4-methylanilino)methyl]isoindole-1,3-dione.
Chemical Property Profile of 2-[[(4-Methylphenyl)amino]methyl]-1H-isoindole-1,3(2H)-dione
Property Insights of 2-[[(4-Methylphenyl)amino]methyl]-1H-isoindole-1,3(2H)-dione
The XLogP value of 3.6 indicates that 2-[[(4-Methylphenyl)amino]methyl]-1H-isoindole-1,3(2H)-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.4 Ų, 2-[[(4-Methylphenyl)amino]methyl]-1H-isoindole-1,3(2H)-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[[(4-Methylphenyl)amino]methyl]-1H-isoindole-1,3(2H)-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 2-[[(4-Methylphenyl)amino]methyl]-1H-isoindole-1,3(2H)-dione?
The CAS number of 2-[[(4-Methylphenyl)amino]methyl]-1H-isoindole-1,3(2H)-dione is 30818-66-7.
What is the molecular formula of 2-[[(4-Methylphenyl)amino]methyl]-1H-isoindole-1,3(2H)-dione?
The molecular formula of 2-[[(4-Methylphenyl)amino]methyl]-1H-isoindole-1,3(2H)-dione is C16H14N2O2.
What is the molecular weight of 2-[[(4-Methylphenyl)amino]methyl]-1H-isoindole-1,3(2H)-dione?
The molecular weight of 2-[[(4-Methylphenyl)amino]methyl]-1H-isoindole-1,3(2H)-dione is 266.11 g/mol.
Where can I buy 2-[[(4-Methylphenyl)amino]methyl]-1H-isoindole-1,3(2H)-dione?
You can request a quote for 2-[[(4-Methylphenyl)amino]methyl]-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-[[(4-Methylphenyl)amino]methyl]-1H-isoindole-1,3(2H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-[[(4-Methylphenyl)amino]methyl]-1H-isoindole-1,3(2H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.