RefChem:595143
TL;DR: RefChem:595143 (CAS 617696-82-9) is a chemical compound with molecular formula C30H25N3O5S2 and molecular weight 571.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[[2-[(3Z)-3-[3-[(4-methylphenyl)methyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]-2-oxoindol-1-yl]acetyl]amino]benzoate
Also Known As: SALOR-INT L441201-1EA, ethyl 4-[({(3Z)-3-[3-(4-methylbenzyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]-2-oxo-2,3-dihydro-1H-indol-1-yl}acetyl)amino]benzoate, 644-369-1, Ethyl 4-((((3Z)-3-(3-(4-methylbenzyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)-2-oxo-2,3-dihydro-1H-indol-1-YL)acetyl)amino)benzoate, ethyl 4-[[2-[(3Z)-3-[3-[(4-methylphenyl)methyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]-2-oxoindol-1-yl]acetyl]amino]benzoate
| Molecular Formula | C30H25N3O5S2 |
|---|---|
| Molecular Weight | 571.12 g/mol |
| LogP | 4.92862 |
| Topological Polar Surface Area | 96.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 571.12354 |
| Heavy Atoms | 40 |
| Complexity | 1564.9133 |
Chemical Identifiers
| CAS Number | 617696-82-9 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)NC(=O)CN2C3=CC=CC=C3/C(=C/4\C(=O)N(C(=S)S4)CC5=CC=C(C=C5)C)/C2=O |
Product Overview
RefChem:595143 (CAS 617696-82-9), with molecular formula C30H25N3O5S2 and molecular weight 571.12 g/mol. IUPAC: ethyl 4-[[2-[(3Z)-3-[3-[(4-methylphenyl)methyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]-2-oxoindol-1-yl]acetyl]amino]benzoate.
Chemical Property Profile of RefChem:595143
Property Insights of RefChem:595143
The XLogP value of 4.92862 indicates that RefChem:595143 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.02 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:595143. Following Lipinski's Rule of Five, RefChem:595143 has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:595143?
The CAS number of RefChem:595143 is 617696-82-9.
What is the molecular formula of RefChem:595143?
The molecular formula of RefChem:595143 is C30H25N3O5S2.
What is the molecular weight of RefChem:595143?
The molecular weight of RefChem:595143 is 571.12 g/mol.
Where can I buy RefChem:595143?
You can request a quote for RefChem:595143 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:595143?
Yes, KEHONG BIO provides custom synthesis services for RefChem:595143 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.