3-(2-bromoethyl)-3-methyl-1-phenyl-1,3-dihydro-2H-indol-2-one
TL;DR: 3-(2-bromoethyl)-3-methyl-1-phenyl-1,3-dihydro-2H-indol-2-one (CAS 496970-05-9) is a chemical compound with molecular formula C17H16BrNO and molecular weight 329.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-bromoethyl)-3-methyl-1-phenylindol-2-one
Also Known As: 3-(2-bromoethyl)-3-methyl-1-phenyl-1,3-dihydro-2H-indol-2-one, 3-(2-bromoethyl)-3-methyl-1-phenylindol-2-one, AO-435/41051605
| Molecular Formula | C17H16BrNO |
|---|---|
| Molecular Weight | 329.04 g/mol |
| LogP | 4.4076 |
| Topological Polar Surface Area | 20.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 329.04153 |
| Heavy Atoms | 20 |
| Complexity | 640.44806 |
Chemical Identifiers
| CAS Number | 496970-05-9 |
|---|---|
| SMILES | CC1(C2=CC=CC=C2N(C1=O)C3=CC=CC=C3)CCBr |
Product Overview
3-(2-bromoethyl)-3-methyl-1-phenyl-1,3-dihydro-2H-indol-2-one (CAS 496970-05-9), with molecular formula C17H16BrNO and molecular weight 329.04 g/mol. IUPAC: 3-(2-bromoethyl)-3-methyl-1-phenylindol-2-one.
Chemical Property Profile of 3-(2-bromoethyl)-3-methyl-1-phenyl-1,3-dihydro-2H-indol-2-one
Property Insights of 3-(2-bromoethyl)-3-methyl-1-phenyl-1,3-dihydro-2H-indol-2-one
The XLogP value of 4.4076 indicates that 3-(2-bromoethyl)-3-methyl-1-phenyl-1,3-dihydro-2H-indol-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.31 Ų, 3-(2-bromoethyl)-3-methyl-1-phenyl-1,3-dihydro-2H-indol-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(2-bromoethyl)-3-methyl-1-phenyl-1,3-dihydro-2H-indol-2-one has 0 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-(2-bromoethyl)-3-methyl-1-phenyl-1,3-dihydro-2H-indol-2-one?
The CAS number of 3-(2-bromoethyl)-3-methyl-1-phenyl-1,3-dihydro-2H-indol-2-one is 496970-05-9.
What is the molecular formula of 3-(2-bromoethyl)-3-methyl-1-phenyl-1,3-dihydro-2H-indol-2-one?
The molecular formula of 3-(2-bromoethyl)-3-methyl-1-phenyl-1,3-dihydro-2H-indol-2-one is C17H16BrNO.
What is the molecular weight of 3-(2-bromoethyl)-3-methyl-1-phenyl-1,3-dihydro-2H-indol-2-one?
The molecular weight of 3-(2-bromoethyl)-3-methyl-1-phenyl-1,3-dihydro-2H-indol-2-one is 329.04 g/mol.
Where can I buy 3-(2-bromoethyl)-3-methyl-1-phenyl-1,3-dihydro-2H-indol-2-one?
You can request a quote for 3-(2-bromoethyl)-3-methyl-1-phenyl-1,3-dihydro-2H-indol-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-(2-bromoethyl)-3-methyl-1-phenyl-1,3-dihydro-2H-indol-2-one?
Yes, KEHONG BIO provides custom synthesis services for 3-(2-bromoethyl)-3-methyl-1-phenyl-1,3-dihydro-2H-indol-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.