RefChem:95471
TL;DR: RefChem:95471 (CAS 64375-47-9) is a chemical compound with molecular formula C19H33N3O4S4 and molecular weight 495.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-diethylethanamine;3-[(2E)-2-[(2E)-2-(3-ethyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)ethylidene]-1,3-thiazolidin-3-yl]propane-1-sulfonic acid
Also Known As: 3-Thiazolidinepropanesulfonic acid, 2-(2-(3-ethyl-4-oxo-2-thioxo-5-thiazolidinylidene)ethylidene)-, compd. with N,N-diethylethanamine (1:1), 3-Thiazolidinepropanesulfonic acid, 2-((3-ethyl-4-oxo-2-thioxo-5-thiazolidinylidene)ethylidene)-, compd. with N,N-diethylethanamine (1:1), 3-Thiazolidinepropanesulfonic acid, 2-[(3-ethyl-4-oxo-2-thioxo-5-thiazolidinylidene)ethylidene]-, compd. with N,N-diethylethanamine (1:1), 3-Thiazolidinepropanesulfonic acid, 2-[2-(3-ethyl-4-oxo-2-thioxo-5-thiazolidinylidene)ethylidene]-, compd. with N,N-diethylethanamine (1:1), N,N-diethylethanamine; 3-[(2E)-2-[(2E)-2-(3-ethyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)ethylidene]-1,3-thiazolidin-3-yl]propane-1-sulfonic acid
| Molecular Formula | C19H33N3O4S4 |
|---|---|
| Molecular Weight | 495.14 g/mol |
| LogP | 3.2667 |
| Topological Polar Surface Area | 81.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 495.1354 |
| Heavy Atoms | 30 |
| Complexity | 743.3687 |
Chemical Identifiers
| CAS Number | 64375-47-9 |
|---|---|
| SMILES | CCN1C(=O)/C(=C\C=C\2/N(CCS2)CCCS(=O)(=O)O)/SC1=S.CCN(CC)CC |
Product Overview
RefChem:95471 (CAS 64375-47-9), with molecular formula C19H33N3O4S4 and molecular weight 495.14 g/mol. IUPAC: N,N-diethylethanamine;3-[(2E)-2-[(2E)-2-(3-ethyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)ethylidene]-1,3-thiazolidin-3-yl]propane-1-sulfonic acid.
Chemical Property Profile of RefChem:95471
Property Insights of RefChem:95471
The XLogP value of 3.2667 indicates that RefChem:95471 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.16 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:95471. Following Lipinski's Rule of Five, RefChem:95471 has 1 hydrogen bond donor(s) and 8 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:95471?
The CAS number of RefChem:95471 is 64375-47-9.
What is the molecular formula of RefChem:95471?
The molecular formula of RefChem:95471 is C19H33N3O4S4.
What is the molecular weight of RefChem:95471?
The molecular weight of RefChem:95471 is 495.14 g/mol.
Where can I buy RefChem:95471?
You can request a quote for RefChem:95471 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:95471?
Yes, KEHONG BIO provides custom synthesis services for RefChem:95471 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.