![2-[(3-Bromoanilino)methyl]isoindole-1,3-dione structure](/static/products/7486/7486-94-4.webp)
2-[(3-Bromoanilino)methyl]isoindole-1,3-dione
TL;DR: 2-[(3-Bromoanilino)methyl]isoindole-1,3-dione (CAS 7486-94-4) is a chemical compound with molecular formula C15H11BrN2O2 and molecular weight 330.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3-bromoanilino)methyl]isoindole-1,3-dione
Also Known As: Verbenylamin, 2-[(3-bromoanilino)methyl]isoindole-1,3-dione, BAS 00227050, 2-[(3-Bromo-phenylamino)-methyl]-isoindole-1,3-dione, 2-[(3-Bromoanilino)methyl]-1H-isoindole-1,3(2H)-dione
| Molecular Formula | C15H11BrN2O2 |
|---|---|
| Molecular Weight | 330.00 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 49.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 330.0004 |
| Heavy Atoms | 20 |
| Complexity | 377.0 |
Chemical Identifiers
| CAS Number | 7486-94-4 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)N(C2=O)CNC3=CC(=CC=C3)Br |
| InChIKey | VJDRUBBFWHNLGP-UHFFFAOYSA-N |
Product Overview
2-[(3-Bromoanilino)methyl]isoindole-1,3-dione (CAS 7486-94-4), with molecular formula C15H11BrN2O2 and molecular weight 330.00 g/mol. IUPAC: 2-[(3-bromoanilino)methyl]isoindole-1,3-dione.
Chemical Property Profile of 2-[(3-Bromoanilino)methyl]isoindole-1,3-dione
Property Insights of 2-[(3-Bromoanilino)methyl]isoindole-1,3-dione
The XLogP value of 4.0 indicates that 2-[(3-Bromoanilino)methyl]isoindole-1,3-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-[(3-Bromoanilino)methyl]isoindole-1,3-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[(3-Bromoanilino)methyl]isoindole-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 2-[(3-Bromoanilino)methyl]isoindole-1,3-dione?
The CAS number of 2-[(3-Bromoanilino)methyl]isoindole-1,3-dione is 7486-94-4.
What is the molecular formula of 2-[(3-Bromoanilino)methyl]isoindole-1,3-dione?
The molecular formula of 2-[(3-Bromoanilino)methyl]isoindole-1,3-dione is C15H11BrN2O2.
What is the molecular weight of 2-[(3-Bromoanilino)methyl]isoindole-1,3-dione?
The molecular weight of 2-[(3-Bromoanilino)methyl]isoindole-1,3-dione is 330.00 g/mol.
Where can I buy 2-[(3-Bromoanilino)methyl]isoindole-1,3-dione?
You can request a quote for 2-[(3-Bromoanilino)methyl]isoindole-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 2-[(3-Bromoanilino)methyl]isoindole-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-[(3-Bromoanilino)methyl]isoindole-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.