RefChem:401651
TL;DR: RefChem:401651 (CAS 617694-99-2) is a chemical compound with molecular formula C22H20N2O3S2 and molecular weight 424.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-3-(2-methoxyethyl)-5-[1-[(4-methylphenyl)methyl]-2-oxoindol-3-ylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: IFLab1_005873, SALOR-INT L438332-1EA, IDI1_011276, (3Z)-3-[3-(2-methoxyethyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]-1-(4-methylbenzyl)-1,3-dihydro-2H-indol-2-one, F1423-0833
| Molecular Formula | C22H20N2O3S2 |
|---|---|
| Molecular Weight | 424.09 g/mol |
| LogP | 3.75962 |
| Topological Polar Surface Area | 49.85 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 424.09152 |
| Heavy Atoms | 29 |
| Complexity | 1030.6078 |
Chemical Identifiers
| CAS Number | 617694-99-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CN2C3=CC=CC=C3/C(=C/4\C(=O)N(C(=S)S4)CCOC)/C2=O |
Product Overview
RefChem:401651 (CAS 617694-99-2), with molecular formula C22H20N2O3S2 and molecular weight 424.09 g/mol. IUPAC: (5Z)-3-(2-methoxyethyl)-5-[1-[(4-methylphenyl)methyl]-2-oxoindol-3-ylidene]-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of RefChem:401651
Property Insights of RefChem:401651
The XLogP value of 3.75962 indicates that RefChem:401651 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.85 Ų, RefChem:401651 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:401651 has 0 hydrogen bond donor(s) and 5 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 RefChem:401651?
The CAS number of RefChem:401651 is 617694-99-2.
What is the molecular formula of RefChem:401651?
The molecular formula of RefChem:401651 is C22H20N2O3S2.
What is the molecular weight of RefChem:401651?
The molecular weight of RefChem:401651 is 424.09 g/mol.
Where can I buy RefChem:401651?
You can request a quote for RefChem:401651 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:401651?
Yes, KEHONG BIO provides custom synthesis services for RefChem:401651 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.