![5-Bromo-2-[(4-methoxyphenyl)amino]-1H-benz[de]isoquinoline-1,3(2H)-dione structure](/static/products/3626/362601-91-0.webp)
5-Bromo-2-[(4-methoxyphenyl)amino]-1H-benz[de]isoquinoline-1,3(2H)-dione
TL;DR: 5-Bromo-2-[(4-methoxyphenyl)amino]-1H-benz[de]isoquinoline-1,3(2H)-dione (CAS 362601-91-0) is a chemical compound with molecular formula C19H13BrN2O3 and molecular weight 396.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-bromo-2-(4-methoxyanilino)benzo[de]isoquinoline-1,3-dione
Also Known As: BAS 00547715, 5-Bromo-2-[(4-methoxyphenyl)amino]-1H-benz[de]isoquinoline-1,3(2H)-dione, 5-bromo-2-(4-methoxyanilino)benzo[de]isoquinoline-1,3-dione, 5-bromo-2-[(4-methoxyphenyl)amino]-1H-benzo[de]isoquinoline-1,3(2H)-dione, 5-bromo-2-(4-methoxyanilino)-1H-benzo[de]isoquinoline-1,3(2H)-dione
| Molecular Formula | C19H13BrN2O3 |
|---|---|
| Molecular Weight | 396.01 g/mol |
| LogP | 4.234 |
| Topological Polar Surface Area | 58.64 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 396.01096 |
| Heavy Atoms | 25 |
| Complexity | 1015.10297 |
Chemical Identifiers
| CAS Number | 362601-91-0 |
|---|---|
| SMILES | COC1=CC=C(C=C1)NN2C(=O)C3=CC=CC4=CC(=CC(=C43)C2=O)Br |
Product Overview
5-Bromo-2-[(4-methoxyphenyl)amino]-1H-benz[de]isoquinoline-1,3(2H)-dione (CAS 362601-91-0), with molecular formula C19H13BrN2O3 and molecular weight 396.01 g/mol. IUPAC: 5-bromo-2-(4-methoxyanilino)benzo[de]isoquinoline-1,3-dione.
Chemical Property Profile of 5-Bromo-2-[(4-methoxyphenyl)amino]-1H-benz[de]isoquinoline-1,3(2H)-dione
Property Insights of 5-Bromo-2-[(4-methoxyphenyl)amino]-1H-benz[de]isoquinoline-1,3(2H)-dione
The XLogP value of 4.234 indicates that 5-Bromo-2-[(4-methoxyphenyl)amino]-1H-benz[de]isoquinoline-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 58.64 Ų, 5-Bromo-2-[(4-methoxyphenyl)amino]-1H-benz[de]isoquinoline-1,3(2H)-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Bromo-2-[(4-methoxyphenyl)amino]-1H-benz[de]isoquinoline-1,3(2H)-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-methoxyphenyl)amino]-1H-benz[de]isoquinoline-1,3(2H)-dione?
The CAS number of 5-Bromo-2-[(4-methoxyphenyl)amino]-1H-benz[de]isoquinoline-1,3(2H)-dione is 362601-91-0.
What is the molecular formula of 5-Bromo-2-[(4-methoxyphenyl)amino]-1H-benz[de]isoquinoline-1,3(2H)-dione?
The molecular formula of 5-Bromo-2-[(4-methoxyphenyl)amino]-1H-benz[de]isoquinoline-1,3(2H)-dione is C19H13BrN2O3.
What is the molecular weight of 5-Bromo-2-[(4-methoxyphenyl)amino]-1H-benz[de]isoquinoline-1,3(2H)-dione?
The molecular weight of 5-Bromo-2-[(4-methoxyphenyl)amino]-1H-benz[de]isoquinoline-1,3(2H)-dione is 396.01 g/mol.
Where can I buy 5-Bromo-2-[(4-methoxyphenyl)amino]-1H-benz[de]isoquinoline-1,3(2H)-dione?
You can request a quote for 5-Bromo-2-[(4-methoxyphenyl)amino]-1H-benz[de]isoquinoline-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 5-Bromo-2-[(4-methoxyphenyl)amino]-1H-benz[de]isoquinoline-1,3(2H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 5-Bromo-2-[(4-methoxyphenyl)amino]-1H-benz[de]isoquinoline-1,3(2H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.