PubChem SID: 26726147
TL;DR: PubChem SID: 26726147 (CAS 1815599-05-3) is a chemical compound with molecular formula C24H21N3O6S3 and molecular weight 543.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3Z)-3-[3-(1,1-dioxothiolan-3-yl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]-2-oxoindol-1-yl]-N-(4-methoxyphenyl)acetamide
Also Known As: PubChem SID: 26726147, 2-[(3Z)-3-[3-(1,1-dioxothiolan-3-yl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]-2-oxoindol-1-yl]-N-(4-methoxyphenyl)acetamide, 2-{3-[3-(1,1-Dioxo-tetrahydro-1lambda*6*-thiophen-3-yl)-4-oxo-2-thioxo-thiazolidin-(5Z)-ylidene]-2-oxo- 2,3-dihydro-indol-1-yl}-N-(4-methoxy-phenyl)-acetamide, (Z)-2-(3-(3-(1,1-dioxidotetrahydrothiophen-3-yl)-4-oxo-2-thioxothiazolidin-5-ylidene)-2-oxoindolin-1-yl)-N-(4-methoxyphenyl)acetamide, 2-[(3Z)-3-[3-(1,1-diketothiolan-3-yl)-4-keto-2-thioxo-thiazolidin-5-ylidene]-2-keto-indolin-1-yl]-N-(4-methoxyphenyl)acetamide
| Molecular Formula | C24H21N3O6S3 |
|---|---|
| Molecular Weight | 543.06 g/mol |
| LogP | 2.439 |
| Topological Polar Surface Area | 113.09 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 543.05927 |
| Heavy Atoms | 36 |
| Complexity | 1435.2472 |
Chemical Identifiers
| CAS Number | 1815599-05-3 |
|---|---|
| SMILES | COC1=CC=C(C=C1)NC(=O)CN2C3=CC=CC=C3/C(=C/4\C(=O)N(C(=S)S4)C5CCS(=O)(=O)C5)/C2=O |
Product Overview
PubChem SID: 26726147 (CAS 1815599-05-3), with molecular formula C24H21N3O6S3 and molecular weight 543.06 g/mol. IUPAC: 2-[(3Z)-3-[3-(1,1-dioxothiolan-3-yl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]-2-oxoindol-1-yl]-N-(4-methoxyphenyl)acetamide.
Chemical Property Profile of PubChem SID: 26726147
Property Insights of PubChem SID: 26726147
The XLogP value of 2.439 suggests moderate lipophilicity, balancing water solubility and membrane permeability for PubChem SID: 26726147. The TPSA of 113.09 Ų falls within the moderate polarity range, balancing permeability and solubility for PubChem SID: 26726147. Following Lipinski's Rule of Five, PubChem SID: 26726147 has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of PubChem SID: 26726147?
The CAS number of PubChem SID: 26726147 is 1815599-05-3.
What is the molecular formula of PubChem SID: 26726147?
The molecular formula of PubChem SID: 26726147 is C24H21N3O6S3.
What is the molecular weight of PubChem SID: 26726147?
The molecular weight of PubChem SID: 26726147 is 543.06 g/mol.
Where can I buy PubChem SID: 26726147?
You can request a quote for PubChem SID: 26726147 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for PubChem SID: 26726147?
Yes, KEHONG BIO provides custom synthesis services for PubChem SID: 26726147 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.