CDS1_003622
TL;DR: CDS1_003622 (CAS 299911-76-5) is a chemical compound with molecular formula C22H20ClNO3S2 and molecular weight 445.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5E)-5-[[5-chloro-2-[2-(2-prop-2-enylphenoxy)ethoxy]phenyl]methylidene]-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: CDS1_003622, BIM-0010996.P001, (5E)-5-[[5-chloro-2-[2-(2-prop-2-enylphenoxy)ethoxy]phenyl]methylidene]-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one, (5E)-5-(5-chloro-2-{2-[2-(prop-2-en-1-yl)phenoxy]ethoxy}benzylidene)-3-methyl-2-thioxo-1,3-thiazolidin-4-one
| Molecular Formula | C22H20ClNO3S2 |
|---|---|
| Molecular Weight | 445.06 g/mol |
| LogP | 5.3573 |
| Topological Polar Surface Area | 38.77 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 445.0573 |
| Heavy Atoms | 29 |
| Complexity | 974.2798 |
Chemical Identifiers
| CAS Number | 299911-76-5 |
|---|---|
| SMILES | CN1C(=O)/C(=C\C2=C(C=CC(=C2)Cl)OCCOC3=CC=CC=C3CC=C)/SC1=S |
Product Overview
CDS1_003622 (CAS 299911-76-5), with molecular formula C22H20ClNO3S2 and molecular weight 445.06 g/mol. IUPAC: (5E)-5-[[5-chloro-2-[2-(2-prop-2-enylphenoxy)ethoxy]phenyl]methylidene]-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of CDS1_003622
Property Insights of CDS1_003622
The XLogP value of 5.3573 indicates that CDS1_003622 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.77 Ų, CDS1_003622 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, CDS1_003622 has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of CDS1_003622?
The CAS number of CDS1_003622 is 299911-76-5.
What is the molecular formula of CDS1_003622?
The molecular formula of CDS1_003622 is C22H20ClNO3S2.
What is the molecular weight of CDS1_003622?
The molecular weight of CDS1_003622 is 445.06 g/mol.
Where can I buy CDS1_003622?
You can request a quote for CDS1_003622 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CDS1_003622?
Yes, KEHONG BIO provides custom synthesis services for CDS1_003622 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.