oxoindole-thioxothiazolidinone, 28
TL;DR: oxoindole-thioxothiazolidinone, 28 (CAS 299952-96-8) is a chemical compound with molecular formula C20H13N3O6S2 and molecular weight 455.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3Z)-3-[3-[(2-hydroxybenzoyl)amino]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]-2-oxoindol-1-yl]acetic acid
Also Known As: oxoindole-thioxothiazolidinone, 28, BAS 00502990, {3-[3-(2-Hydroxy-benzoylamino)-4-oxo-2-thioxo-thiazolidin-5-ylidene]-2-oxo-2,3-dihydro-indol-1-yl}-acetic acid, ((3Z)-3-{3-[(2-hydroxybenzoyl)amino]-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene}-2-oxo-2,3-dihydro-1H-indol-1-yl)acetic acid, (Z)-2-(3-(3-(2-hydroxybenzamido)-4-oxo-2-thioxothiazolidin-5-ylidene)-2-oxoindolin-1-yl)acetic acid
| Molecular Formula | C20H13N3O6S2 |
|---|---|
| Molecular Weight | 455.02 g/mol |
| LogP | 1.7398 |
| Topological Polar Surface Area | 127.25 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 455.02457 |
| Heavy Atoms | 31 |
| Complexity | 1208.9062 |
Chemical Identifiers
| CAS Number | 299952-96-8 |
|---|---|
| SMILES | C1=CC=C2C(=C1)/C(=C/3\C(=O)N(C(=S)S3)NC(=O)C4=CC=CC=C4O)/C(=O)N2CC(=O)O |
Product Overview
oxoindole-thioxothiazolidinone, 28 (CAS 299952-96-8), with molecular formula C20H13N3O6S2 and molecular weight 455.02 g/mol. IUPAC: 2-[(3Z)-3-[3-[(2-hydroxybenzoyl)amino]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]-2-oxoindol-1-yl]acetic acid.
Chemical Property Profile of oxoindole-thioxothiazolidinone, 28
Property Insights of oxoindole-thioxothiazolidinone, 28
The XLogP value of 1.7398 suggests moderate lipophilicity, balancing water solubility and membrane permeability for oxoindole-thioxothiazolidinone, 28. The TPSA of 127.25 Ų falls within the moderate polarity range, balancing permeability and solubility for oxoindole-thioxothiazolidinone, 28. Following Lipinski's Rule of Five, oxoindole-thioxothiazolidinone, 28 has 3 hydrogen bond donor(s) and 7 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 oxoindole-thioxothiazolidinone, 28?
The CAS number of oxoindole-thioxothiazolidinone, 28 is 299952-96-8.
What is the molecular formula of oxoindole-thioxothiazolidinone, 28?
The molecular formula of oxoindole-thioxothiazolidinone, 28 is C20H13N3O6S2.
What is the molecular weight of oxoindole-thioxothiazolidinone, 28?
The molecular weight of oxoindole-thioxothiazolidinone, 28 is 455.02 g/mol.
Where can I buy oxoindole-thioxothiazolidinone, 28?
You can request a quote for oxoindole-thioxothiazolidinone, 28 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for oxoindole-thioxothiazolidinone, 28?
Yes, KEHONG BIO provides custom synthesis services for oxoindole-thioxothiazolidinone, 28 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.