5-bromo-7-methyl-1-(3-phenoxypropyl)-1H-indole-2,3-dione
TL;DR: 5-bromo-7-methyl-1-(3-phenoxypropyl)-1H-indole-2,3-dione (CAS 825599-55-1) is a chemical compound with molecular formula C18H16BrNO3 and molecular weight 373.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-bromo-7-methyl-1-(3-phenoxypropyl)indole-2,3-dione
Also Known As: 5-bromo-7-methyl-1-(3-phenoxypropyl)-1H-indole-2,3-dione, 5-bromo-7-methyl-1-(3-phenoxypropyl)indole-2,3-dione, 5-bromo-7-methyl-1-(3-phenoxypropyl)-2,3-dihydro-1H-indole-2,3-dione, AT-057/42649916, 5-bromo-7-methyl-1-(3-phenoxypropyl)indoline-2,3-dione
| Molecular Formula | C18H16BrNO3 |
|---|---|
| Molecular Weight | 373.03 g/mol |
| LogP | 3.75592 |
| Topological Polar Surface Area | 46.61 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 373.03137 |
| Heavy Atoms | 23 |
| Complexity | 758.36206 |
Chemical Identifiers
| CAS Number | 825599-55-1 |
|---|---|
| SMILES | CC1=CC(=CC2=C1N(C(=O)C2=O)CCCOC3=CC=CC=C3)Br |
Product Overview
5-bromo-7-methyl-1-(3-phenoxypropyl)-1H-indole-2,3-dione (CAS 825599-55-1), with molecular formula C18H16BrNO3 and molecular weight 373.03 g/mol. IUPAC: 5-bromo-7-methyl-1-(3-phenoxypropyl)indole-2,3-dione.
Chemical Property Profile of 5-bromo-7-methyl-1-(3-phenoxypropyl)-1H-indole-2,3-dione
Property Insights of 5-bromo-7-methyl-1-(3-phenoxypropyl)-1H-indole-2,3-dione
The XLogP value of 3.75592 indicates that 5-bromo-7-methyl-1-(3-phenoxypropyl)-1H-indole-2,3-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.61 Ų, 5-bromo-7-methyl-1-(3-phenoxypropyl)-1H-indole-2,3-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-bromo-7-methyl-1-(3-phenoxypropyl)-1H-indole-2,3-dione has 0 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 5-bromo-7-methyl-1-(3-phenoxypropyl)-1H-indole-2,3-dione?
The CAS number of 5-bromo-7-methyl-1-(3-phenoxypropyl)-1H-indole-2,3-dione is 825599-55-1.
What is the molecular formula of 5-bromo-7-methyl-1-(3-phenoxypropyl)-1H-indole-2,3-dione?
The molecular formula of 5-bromo-7-methyl-1-(3-phenoxypropyl)-1H-indole-2,3-dione is C18H16BrNO3.
What is the molecular weight of 5-bromo-7-methyl-1-(3-phenoxypropyl)-1H-indole-2,3-dione?
The molecular weight of 5-bromo-7-methyl-1-(3-phenoxypropyl)-1H-indole-2,3-dione is 373.03 g/mol.
Where can I buy 5-bromo-7-methyl-1-(3-phenoxypropyl)-1H-indole-2,3-dione?
You can request a quote for 5-bromo-7-methyl-1-(3-phenoxypropyl)-1H-indole-2,3-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-7-methyl-1-(3-phenoxypropyl)-1H-indole-2,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 5-bromo-7-methyl-1-(3-phenoxypropyl)-1H-indole-2,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.