CDS1_003877
TL;DR: CDS1_003877 (CAS 292076-22-3) is a chemical compound with molecular formula C21H19NO4S2 and molecular weight 413.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[(Z)-(3-ethyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-2-methoxyphenyl] 3-methylbenzoate
Also Known As: CDS1_003877, BAS 13119063, BIM-0017473.P001, AM-879/11774008, 4-[(3-ethyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-2-methoxyphenyl 3-methylbenzoate
| Molecular Formula | C21H19NO4S2 |
|---|---|
| Molecular Weight | 413.08 g/mol |
| LogP | 4.44392 |
| Topological Polar Surface Area | 55.84 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 413.07556 |
| Heavy Atoms | 28 |
| Complexity | 984.1209 |
Chemical Identifiers
| CAS Number | 292076-22-3 |
|---|---|
| SMILES | CCN1C(=O)/C(=C/C2=CC(=C(C=C2)OC(=O)C3=CC=CC(=C3)C)OC)/SC1=S |
Product Overview
CDS1_003877 (CAS 292076-22-3), with molecular formula C21H19NO4S2 and molecular weight 413.08 g/mol. IUPAC: [4-[(Z)-(3-ethyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-2-methoxyphenyl] 3-methylbenzoate.
Chemical Property Profile of CDS1_003877
Property Insights of CDS1_003877
The XLogP value of 4.44392 indicates that CDS1_003877 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.84 Ų, CDS1_003877 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, CDS1_003877 has 0 hydrogen bond donor(s) and 6 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_003877?
The CAS number of CDS1_003877 is 292076-22-3.
What is the molecular formula of CDS1_003877?
The molecular formula of CDS1_003877 is C21H19NO4S2.
What is the molecular weight of CDS1_003877?
The molecular weight of CDS1_003877 is 413.08 g/mol.
Where can I buy CDS1_003877?
You can request a quote for CDS1_003877 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CDS1_003877?
Yes, KEHONG BIO provides custom synthesis services for CDS1_003877 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.