5-(5-Bromo-1-ethyl-2-oxoindolin-3-ylidene)-3-(sec-butyl)-2-thioxothiazolidin-4-one
TL;DR: 5-(5-Bromo-1-ethyl-2-oxoindolin-3-ylidene)-3-(sec-butyl)-2-thioxothiazolidin-4-one (CAS 617697-72-0) is a chemical compound with molecular formula C17H17BrN2O2S2 and molecular weight 423.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-5-(5-bromo-1-ethyl-2-oxoindol-3-ylidene)-3-butan-2-yl-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: 5-(5-Bromo-1-ethyl-2-oxoindolin-3-ylidene)-3-(sec-butyl)-2-thioxothiazolidin-4-one, (3Z)-5-BROMO-3-(3-SEC-BUTYL-4-OXO-2-THIOXO-1,3-THIAZOLIDIN-5-YLIDENE)-1-ETHYL-1,3-DIHYDRO-2H-INDOL-2-ONE, (3Z)-5-bromo-3-[3-(butan-2-yl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]-1-ethyl-1,3-dihydro-2H-indol-2-one, (5Z)-5-(5-bromo-1-ethyl-2-oxoindol-3-ylidene)-3-butan-2-yl-2-sulfanylidene-1,3-thiazolidin-4-one, 5-bromo-3-(3-butan-2-yl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)-1-ethyl-indol-2-one
| Molecular Formula | C17H17BrN2O2S2 |
|---|---|
| Molecular Weight | 423.99 g/mol |
| LogP | 4.1855 |
| Topological Polar Surface Area | 40.62 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 423.9915 |
| Heavy Atoms | 24 |
| Complexity | 790.7953 |
Chemical Identifiers
| CAS Number | 617697-72-0 |
|---|---|
| SMILES | CCC(C)N1C(=O)/C(=C/2\C3=C(C=CC(=C3)Br)N(C2=O)CC)/SC1=S |
Product Overview
5-(5-Bromo-1-ethyl-2-oxoindolin-3-ylidene)-3-(sec-butyl)-2-thioxothiazolidin-4-one (CAS 617697-72-0), with molecular formula C17H17BrN2O2S2 and molecular weight 423.99 g/mol. IUPAC: (5Z)-5-(5-bromo-1-ethyl-2-oxoindol-3-ylidene)-3-butan-2-yl-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of 5-(5-Bromo-1-ethyl-2-oxoindolin-3-ylidene)-3-(sec-butyl)-2-thioxothiazolidin-4-one
Property Insights of 5-(5-Bromo-1-ethyl-2-oxoindolin-3-ylidene)-3-(sec-butyl)-2-thioxothiazolidin-4-one
The XLogP value of 4.1855 indicates that 5-(5-Bromo-1-ethyl-2-oxoindolin-3-ylidene)-3-(sec-butyl)-2-thioxothiazolidin-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.62 Ų, 5-(5-Bromo-1-ethyl-2-oxoindolin-3-ylidene)-3-(sec-butyl)-2-thioxothiazolidin-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(5-Bromo-1-ethyl-2-oxoindolin-3-ylidene)-3-(sec-butyl)-2-thioxothiazolidin-4-one has 0 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-(5-Bromo-1-ethyl-2-oxoindolin-3-ylidene)-3-(sec-butyl)-2-thioxothiazolidin-4-one?
The CAS number of 5-(5-Bromo-1-ethyl-2-oxoindolin-3-ylidene)-3-(sec-butyl)-2-thioxothiazolidin-4-one is 617697-72-0.
What is the molecular formula of 5-(5-Bromo-1-ethyl-2-oxoindolin-3-ylidene)-3-(sec-butyl)-2-thioxothiazolidin-4-one?
The molecular formula of 5-(5-Bromo-1-ethyl-2-oxoindolin-3-ylidene)-3-(sec-butyl)-2-thioxothiazolidin-4-one is C17H17BrN2O2S2.
What is the molecular weight of 5-(5-Bromo-1-ethyl-2-oxoindolin-3-ylidene)-3-(sec-butyl)-2-thioxothiazolidin-4-one?
The molecular weight of 5-(5-Bromo-1-ethyl-2-oxoindolin-3-ylidene)-3-(sec-butyl)-2-thioxothiazolidin-4-one is 423.99 g/mol.
Where can I buy 5-(5-Bromo-1-ethyl-2-oxoindolin-3-ylidene)-3-(sec-butyl)-2-thioxothiazolidin-4-one?
You can request a quote for 5-(5-Bromo-1-ethyl-2-oxoindolin-3-ylidene)-3-(sec-butyl)-2-thioxothiazolidin-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(5-Bromo-1-ethyl-2-oxoindolin-3-ylidene)-3-(sec-butyl)-2-thioxothiazolidin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 5-(5-Bromo-1-ethyl-2-oxoindolin-3-ylidene)-3-(sec-butyl)-2-thioxothiazolidin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.