![5-Bromo-2-[(4-phenoxyanilino)methyl]isoindole-1,3-dione structure](/static/products/3012/301210-53-7.webp)
5-Bromo-2-[(4-phenoxyanilino)methyl]isoindole-1,3-dione
TL;DR: 5-Bromo-2-[(4-phenoxyanilino)methyl]isoindole-1,3-dione (CAS 301210-53-7) is a chemical compound with molecular formula C21H15BrN2O3 and molecular weight 422.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-bromo-2-[(4-phenoxyanilino)methyl]isoindole-1,3-dione
Also Known As: BAS 00121207, 5-bromo-2-[(4-phenoxyanilino)methyl]isoindole-1,3-dione, 5-bromo-2-[(4-phenoxyanilino)methyl]-1H-isoindole-1,3(2H)-dione, 5-Bromo-2-[(4-phenoxy-phenylamino)-methyl]-isoindole-1,3-dione, 5-bromo-2-{[(4-phenoxyphenyl)amino]methyl}-1H-isoindole-1,3(2H)-dione
| Molecular Formula | C21H15BrN2O3 |
|---|---|
| Molecular Weight | 422.03 g/mol |
| LogP | 4.907 |
| Topological Polar Surface Area | 58.64 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 422.0266 |
| Heavy Atoms | 27 |
| Complexity | 1003.6951 |
Chemical Identifiers
| CAS Number | 301210-53-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)OC2=CC=C(C=C2)NCN3C(=O)C4=C(C3=O)C=C(C=C4)Br |
Product Overview
5-Bromo-2-[(4-phenoxyanilino)methyl]isoindole-1,3-dione (CAS 301210-53-7), with molecular formula C21H15BrN2O3 and molecular weight 422.03 g/mol. IUPAC: 5-bromo-2-[(4-phenoxyanilino)methyl]isoindole-1,3-dione.
Chemical Property Profile of 5-Bromo-2-[(4-phenoxyanilino)methyl]isoindole-1,3-dione
Property Insights of 5-Bromo-2-[(4-phenoxyanilino)methyl]isoindole-1,3-dione
The XLogP value of 4.907 indicates that 5-Bromo-2-[(4-phenoxyanilino)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 58.64 Ų, 5-Bromo-2-[(4-phenoxyanilino)methyl]isoindole-1,3-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Bromo-2-[(4-phenoxyanilino)methyl]isoindole-1,3-dione has 1 hydrogen bond donor(s) and 4 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-Bromo-2-[(4-phenoxyanilino)methyl]isoindole-1,3-dione?
The CAS number of 5-Bromo-2-[(4-phenoxyanilino)methyl]isoindole-1,3-dione is 301210-53-7.
What is the molecular formula of 5-Bromo-2-[(4-phenoxyanilino)methyl]isoindole-1,3-dione?
The molecular formula of 5-Bromo-2-[(4-phenoxyanilino)methyl]isoindole-1,3-dione is C21H15BrN2O3.
What is the molecular weight of 5-Bromo-2-[(4-phenoxyanilino)methyl]isoindole-1,3-dione?
The molecular weight of 5-Bromo-2-[(4-phenoxyanilino)methyl]isoindole-1,3-dione is 422.03 g/mol.
Where can I buy 5-Bromo-2-[(4-phenoxyanilino)methyl]isoindole-1,3-dione?
You can request a quote for 5-Bromo-2-[(4-phenoxyanilino)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 5-Bromo-2-[(4-phenoxyanilino)methyl]isoindole-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 5-Bromo-2-[(4-phenoxyanilino)methyl]isoindole-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.