BAS 00534130
TL;DR: BAS 00534130 (CAS 299952-91-3) is a chemical compound with molecular formula C23H31NO5S2 and molecular weight 465.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
11-[(5Z)-5-[(3-ethoxy-4-hydroxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]undecanoic acid
Also Known As: BAS 00534130, 11-[(5Z)-5-(3-ethoxy-4-hydroxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]undecanoic acid, (Z)-11-(5-(3-ethoxy-4-hydroxybenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)undecanoic acid, 11-[(5Z)-5-[(3-ethoxy-4-hydroxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]undecanoic acid
| Molecular Formula | C23H31NO5S2 |
|---|---|
| Molecular Weight | 465.16 g/mol |
| LogP | 5.5876 |
| Topological Polar Surface Area | 87.07 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 14 |
| Exact Mass | 465.16437 |
| Heavy Atoms | 31 |
| Complexity | 809.1566 |
Chemical Identifiers
| CAS Number | 299952-91-3 |
|---|---|
| SMILES | CCOC1=C(C=CC(=C1)/C=C\2/C(=O)N(C(=S)S2)CCCCCCCCCCC(=O)O)O |
Product Overview
BAS 00534130 (CAS 299952-91-3), with molecular formula C23H31NO5S2 and molecular weight 465.16 g/mol. IUPAC: 11-[(5Z)-5-[(3-ethoxy-4-hydroxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]undecanoic acid.
Chemical Property Profile of BAS 00534130
Property Insights of BAS 00534130
The XLogP value of 5.5876 indicates that BAS 00534130 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.07 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00534130. Following Lipinski's Rule of Five, BAS 00534130 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00534130?
The CAS number of BAS 00534130 is 299952-91-3.
What is the molecular formula of BAS 00534130?
The molecular formula of BAS 00534130 is C23H31NO5S2.
What is the molecular weight of BAS 00534130?
The molecular weight of BAS 00534130 is 465.16 g/mol.
Where can I buy BAS 00534130?
You can request a quote for BAS 00534130 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00534130?
Yes, KEHONG BIO provides custom synthesis services for BAS 00534130 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.