3-(3,5-dibromo-4-hydroxybenzylidene)-5-iodoindolin-2-one
TL;DR: 3-(3,5-dibromo-4-hydroxybenzylidene)-5-iodoindolin-2-one (CAS 220904-83-6) is a chemical compound with molecular formula C15H8Br2INO2 and molecular weight 518.80 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3,5-dibromo-4-hydroxybenzylidene)-5-iodoindolin-2-one
3-[(3,5-dibromo-4-hydroxyphenyl)methylidene]-5-iodo-1H-indol-2-one
Also Known As: GW305074X, GW 5074, STO521, KBio2_000615, KBio2_003183
| Molecular Formula | C15H8Br2INO2 |
|---|---|
| Molecular Weight | 518.80 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 49.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 520.7946 |
| Heavy Atoms | 21 |
| Complexity | 447.0 |
Chemical Identifiers
| CAS Number | 220904-83-6 |
|---|---|
| SMILES | C1=CC2=C(C=C1I)C(=CC3=CC(=C(C(=C3)Br)O)Br)C(=O)N2 |
| InChIKey | LMXYVLFTZRPNRV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(3,5-dibromo-4-hydroxybenzylidene)-5-iodoindolin-2-one (CAS 220904-83-6), with molecular formula C15H8Br2INO2 and molecular weight 518.80 g/mol. IUPAC: 3-[(3,5-dibromo-4-hydroxyphenyl)methylidene]-5-iodo-1H-indol-2-one.
Chemical Property Profile of 3-(3,5-dibromo-4-hydroxybenzylidene)-5-iodoindolin-2-one
Property Insights of 3-(3,5-dibromo-4-hydroxybenzylidene)-5-iodoindolin-2-one
The XLogP value of 4.6 indicates that 3-(3,5-dibromo-4-hydroxybenzylidene)-5-iodoindolin-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.3 Ų, 3-(3,5-dibromo-4-hydroxybenzylidene)-5-iodoindolin-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(3,5-dibromo-4-hydroxybenzylidene)-5-iodoindolin-2-one has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-(3,5-dibromo-4-hydroxybenzylidene)-5-iodoindolin-2-one?
The CAS number of 3-(3,5-dibromo-4-hydroxybenzylidene)-5-iodoindolin-2-one is 220904-83-6.
What is the molecular formula of 3-(3,5-dibromo-4-hydroxybenzylidene)-5-iodoindolin-2-one?
The molecular formula of 3-(3,5-dibromo-4-hydroxybenzylidene)-5-iodoindolin-2-one is C15H8Br2INO2.
What is the molecular weight of 3-(3,5-dibromo-4-hydroxybenzylidene)-5-iodoindolin-2-one?
The molecular weight of 3-(3,5-dibromo-4-hydroxybenzylidene)-5-iodoindolin-2-one is 518.80 g/mol.
Where can I buy 3-(3,5-dibromo-4-hydroxybenzylidene)-5-iodoindolin-2-one?
You can request a quote for 3-(3,5-dibromo-4-hydroxybenzylidene)-5-iodoindolin-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-(3,5-dibromo-4-hydroxybenzylidene)-5-iodoindolin-2-one?
Yes, KEHONG BIO provides custom synthesis services for 3-(3,5-dibromo-4-hydroxybenzylidene)-5-iodoindolin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.