Dye xxiii
TL;DR: Dye xxiii (CAS 77673-48-4) is a chemical compound with molecular formula C23H26N2O4S3 and molecular weight 490.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[4-[4-(4-oxo-3-propyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)but-2-enylidene]quinolin-1-yl]butane-1-sulfonic acid
Also Known As: Dye xxiii, (3-Propylrhodanine-(5))-(1-delta-triethylammonium sulfobutyl-1,4-dihydroquinoline-(4))-tetramethinemerocyanine, 1(4H)-Quinolinebutanesulfonicacid, 4-[4-(4-oxo-3-propyl-2-thioxo-5-thiazolidinylidene)-2-buten-1-ylidene]-, 4-[4-[4-(4-Oxo-3-propyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)but-2-enylidene]quinolin-1-yl]butane-1-sulfonic acid
| Molecular Formula | C23H26N2O4S3 |
|---|---|
| Molecular Weight | 490.11 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 144.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 490.10547 |
| Heavy Atoms | 32 |
| Complexity | 931.0 |
Chemical Identifiers
| CAS Number | 77673-48-4 |
|---|---|
| SMILES | CCCN1C(=O)C(=CC=CC=C2C=CN(C3=CC=CC=C23)CCCCS(=O)(=O)O)SC1=S |
| InChIKey | JPYNZOOSSSFHQU-UHFFFAOYSA-N |
Product Overview
Dye xxiii (CAS 77673-48-4), with molecular formula C23H26N2O4S3 and molecular weight 490.11 g/mol. IUPAC: 4-[4-[4-(4-oxo-3-propyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)but-2-enylidene]quinolin-1-yl]butane-1-sulfonic acid.
Chemical Property Profile of Dye xxiii
Property Insights of Dye xxiii
The XLogP value of 4.6 indicates that Dye xxiii is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 144.0 Ų indicates high polarity, suggesting Dye xxiii may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Dye xxiii has 1 hydrogen bond donor(s) and 7 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 Dye xxiii?
The CAS number of Dye xxiii is 77673-48-4.
What is the molecular formula of Dye xxiii?
The molecular formula of Dye xxiii is C23H26N2O4S3.
What is the molecular weight of Dye xxiii?
The molecular weight of Dye xxiii is 490.11 g/mol.
Where can I buy Dye xxiii?
You can request a quote for Dye xxiii directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dye xxiii?
Yes, KEHONG BIO provides custom synthesis services for Dye xxiii and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.