(Z)-5-(5-bromo-2-oxoindolin-3-ylidene)-3-(3,4-dimethylphenyl)-2-thioxothiazolidin-4-one
TL;DR: (Z)-5-(5-bromo-2-oxoindolin-3-ylidene)-3-(3,4-dimethylphenyl)-2-thioxothiazolidin-4-one (CAS 307342-81-0) is a chemical compound with molecular formula C19H13BrN2O2S2 and molecular weight 443.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-bromo-3-[3-(3,4-dimethylphenyl)-4-hydroxy-2-sulfanylidene-1,3-thiazol-5-yl]indol-2-one
Also Known As: (Z)-5-(5-bromo-2-oxoindolin-3-ylidene)-3-(3,4-dimethylphenyl)-2-thioxothiazolidin-4-one, (5Z)-5-(5-bromo-2-oxo-1H-indol-3-ylidene)-3-(3,4-dimethylphenyl)-2-sulfanylidene-1,3-thiazolidin-4-one, (3Z)-5-bromo-3-[3-(3,4-dimethylphenyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]-1,3-dihydro-2H-indol-2-one, (5E)-5-(5-bromo-2-oxo-1H-indol-3-ylidene)-3-(3,4-dimethylphenyl)-2-sulfanylidene-1,3-thiazolidin-4-one, 5-(5-bromo-2-oxo-1H-indol-3-ylidene)-3-(3,4-dimethylphenyl)-2-sulfanylidene-1,3-thiazolidin-4-one
| Molecular Formula | C19H13BrN2O2S2 |
|---|---|
| Molecular Weight | 443.96 g/mol |
| LogP | 3.71203 |
| Topological Polar Surface Area | 54.59 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 443.96017 |
| Heavy Atoms | 26 |
| Complexity | 1271.6669 |
Chemical Identifiers
| CAS Number | 307342-81-0 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)N2C(=C(SC2=S)C3=C4C=C(C=CC4=NC3=O)Br)O)C |
Product Overview
(Z)-5-(5-bromo-2-oxoindolin-3-ylidene)-3-(3,4-dimethylphenyl)-2-thioxothiazolidin-4-one (CAS 307342-81-0), with molecular formula C19H13BrN2O2S2 and molecular weight 443.96 g/mol. IUPAC: 5-bromo-3-[3-(3,4-dimethylphenyl)-4-hydroxy-2-sulfanylidene-1,3-thiazol-5-yl]indol-2-one.
Chemical Property Profile of (Z)-5-(5-bromo-2-oxoindolin-3-ylidene)-3-(3,4-dimethylphenyl)-2-thioxothiazolidin-4-one
Property Insights of (Z)-5-(5-bromo-2-oxoindolin-3-ylidene)-3-(3,4-dimethylphenyl)-2-thioxothiazolidin-4-one
The XLogP value of 3.71203 indicates that (Z)-5-(5-bromo-2-oxoindolin-3-ylidene)-3-(3,4-dimethylphenyl)-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 54.59 Ų, (Z)-5-(5-bromo-2-oxoindolin-3-ylidene)-3-(3,4-dimethylphenyl)-2-thioxothiazolidin-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (Z)-5-(5-bromo-2-oxoindolin-3-ylidene)-3-(3,4-dimethylphenyl)-2-thioxothiazolidin-4-one has 1 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 (Z)-5-(5-bromo-2-oxoindolin-3-ylidene)-3-(3,4-dimethylphenyl)-2-thioxothiazolidin-4-one?
The CAS number of (Z)-5-(5-bromo-2-oxoindolin-3-ylidene)-3-(3,4-dimethylphenyl)-2-thioxothiazolidin-4-one is 307342-81-0.
What is the molecular formula of (Z)-5-(5-bromo-2-oxoindolin-3-ylidene)-3-(3,4-dimethylphenyl)-2-thioxothiazolidin-4-one?
The molecular formula of (Z)-5-(5-bromo-2-oxoindolin-3-ylidene)-3-(3,4-dimethylphenyl)-2-thioxothiazolidin-4-one is C19H13BrN2O2S2.
What is the molecular weight of (Z)-5-(5-bromo-2-oxoindolin-3-ylidene)-3-(3,4-dimethylphenyl)-2-thioxothiazolidin-4-one?
The molecular weight of (Z)-5-(5-bromo-2-oxoindolin-3-ylidene)-3-(3,4-dimethylphenyl)-2-thioxothiazolidin-4-one is 443.96 g/mol.
Where can I buy (Z)-5-(5-bromo-2-oxoindolin-3-ylidene)-3-(3,4-dimethylphenyl)-2-thioxothiazolidin-4-one?
You can request a quote for (Z)-5-(5-bromo-2-oxoindolin-3-ylidene)-3-(3,4-dimethylphenyl)-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 (Z)-5-(5-bromo-2-oxoindolin-3-ylidene)-3-(3,4-dimethylphenyl)-2-thioxothiazolidin-4-one?
Yes, KEHONG BIO provides custom synthesis services for (Z)-5-(5-bromo-2-oxoindolin-3-ylidene)-3-(3,4-dimethylphenyl)-2-thioxothiazolidin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.