CDS1_003537
TL;DR: CDS1_003537 (CAS 299903-95-0) is a chemical compound with molecular formula C13H12ClNO2S2 and molecular weight 313.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5E)-5-[(5-chloro-2-ethoxyphenyl)methylidene]-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: CDS1_003537, BIM-0010943.P001, (5E)-5-[(5-chloro-2-ethoxyphenyl)methylidene]-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one, (5E)-5-(5-chloro-2-ethoxybenzylidene)-3-methyl-2-thioxo-1,3-thiazolidin-4-one
| Molecular Formula | C13H12ClNO2S2 |
|---|---|
| Molecular Weight | 313.00 g/mol |
| LogP | 3.5697 |
| Topological Polar Surface Area | 29.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 312.9998 |
| Heavy Atoms | 19 |
| Complexity | 571.76166 |
Chemical Identifiers
| CAS Number | 299903-95-0 |
|---|---|
| SMILES | CCOC1=C(C=C(C=C1)Cl)/C=C/2\C(=O)N(C(=S)S2)C |
Product Overview
CDS1_003537 (CAS 299903-95-0), with molecular formula C13H12ClNO2S2 and molecular weight 313.00 g/mol. IUPAC: (5E)-5-[(5-chloro-2-ethoxyphenyl)methylidene]-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of CDS1_003537
Property Insights of CDS1_003537
The XLogP value of 3.5697 indicates that CDS1_003537 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.54 Ų, CDS1_003537 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, CDS1_003537 has 0 hydrogen bond donor(s) and 4 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 CDS1_003537?
The CAS number of CDS1_003537 is 299903-95-0.
What is the molecular formula of CDS1_003537?
The molecular formula of CDS1_003537 is C13H12ClNO2S2.
What is the molecular weight of CDS1_003537?
The molecular weight of CDS1_003537 is 313.00 g/mol.
Where can I buy CDS1_003537?
You can request a quote for CDS1_003537 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CDS1_003537?
Yes, KEHONG BIO provides custom synthesis services for CDS1_003537 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.