3-Benzyl-5-bromo-1,3-dihydroindol-2-one
TL;DR: 3-Benzyl-5-bromo-1,3-dihydroindol-2-one (CAS 900516-56-5) is a chemical compound with molecular formula C15H12BrNO and molecular weight 301.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-benzyl-5-bromo-1,3-dihydroindol-2-one
Also Known As: 3-Benzyl-5-bromoindoline-2-one, 3-benzyl-5-bromo-1,3-dihydroindol-2-one, 3-benzyl-5-bromo-1,3-dihydro-2H-indol-2-one, J2.718.633E, 3-Benzyl-5-bromo-2,3-dihydro-1H-indole-2-one
| Molecular Formula | C15H12BrNO |
|---|---|
| Molecular Weight | 301.01 g/mol |
| LogP | 3.7275 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 301.01022 |
| Heavy Atoms | 18 |
| Complexity | 594.6975 |
Chemical Identifiers
| CAS Number | 900516-56-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)CC2C3=C(C=CC(=C3)Br)NC2=O |
Product Overview
3-Benzyl-5-bromo-1,3-dihydroindol-2-one (CAS 900516-56-5), with molecular formula C15H12BrNO and molecular weight 301.01 g/mol. IUPAC: 3-benzyl-5-bromo-1,3-dihydroindol-2-one.
Chemical Property Profile of 3-Benzyl-5-bromo-1,3-dihydroindol-2-one
Property Insights of 3-Benzyl-5-bromo-1,3-dihydroindol-2-one
The XLogP value of 3.7275 indicates that 3-Benzyl-5-bromo-1,3-dihydroindol-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, 3-Benzyl-5-bromo-1,3-dihydroindol-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Benzyl-5-bromo-1,3-dihydroindol-2-one has 1 hydrogen bond donor(s) and 1 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 3-Benzyl-5-bromo-1,3-dihydroindol-2-one?
The CAS number of 3-Benzyl-5-bromo-1,3-dihydroindol-2-one is 900516-56-5.
What is the molecular formula of 3-Benzyl-5-bromo-1,3-dihydroindol-2-one?
The molecular formula of 3-Benzyl-5-bromo-1,3-dihydroindol-2-one is C15H12BrNO.
What is the molecular weight of 3-Benzyl-5-bromo-1,3-dihydroindol-2-one?
The molecular weight of 3-Benzyl-5-bromo-1,3-dihydroindol-2-one is 301.01 g/mol.
Where can I buy 3-Benzyl-5-bromo-1,3-dihydroindol-2-one?
You can request a quote for 3-Benzyl-5-bromo-1,3-dihydroindol-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Benzyl-5-bromo-1,3-dihydroindol-2-one?
Yes, KEHONG BIO provides custom synthesis services for 3-Benzyl-5-bromo-1,3-dihydroindol-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.