KST-1A5363
TL;DR: KST-1A5363 (CAS 5269-29-4) is a chemical compound with molecular formula C18H22N2O3S and molecular weight 346.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-cyclohexylimino-3-(2-methylphenyl)-4-oxo-1,3-thiazolidin-5-yl]acetic acid
Also Known As: KST-1A5363, [(2z)-2-(cyclohexylimino)-3-(2-methylphenyl)-4-oxo-1,3-thiazolidin-5-yl]acetic acid, 2-(Cyclohexylimino)-4-oxo-3-(o-tolyl)-5-thiazolidineacetic acid, 5-Thiazolidineacetic acid, 2-(cyclohexylimino)-3-(2-methylphenyl)-4-oxo-, 5-Thiazolidineacetic acid, 2-(cyclohexylimino)-4-oxo-3-(o-tolyl)-
| Molecular Formula | C18H22N2O3S |
|---|---|
| Molecular Weight | 346.14 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 95.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 346.1351 |
| Heavy Atoms | 24 |
| Complexity | 516.0 |
Chemical Identifiers
| CAS Number | 5269-29-4 |
|---|---|
| SMILES | CC1=CC=CC=C1N2C(=O)C(SC2=NC3CCCCC3)CC(=O)O |
| InChIKey | DFYMSSYLAPFLCW-UHFFFAOYSA-N |
Product Overview
KST-1A5363 (CAS 5269-29-4), with molecular formula C18H22N2O3S and molecular weight 346.14 g/mol. IUPAC: 2-[2-cyclohexylimino-3-(2-methylphenyl)-4-oxo-1,3-thiazolidin-5-yl]acetic acid.
Chemical Property Profile of KST-1A5363
Property Insights of KST-1A5363
The XLogP value of 3.6 indicates that KST-1A5363 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.3 Ų falls within the moderate polarity range, balancing permeability and solubility for KST-1A5363. Following Lipinski's Rule of Five, KST-1A5363 has 1 hydrogen bond donor(s) and 5 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 KST-1A5363?
The CAS number of KST-1A5363 is 5269-29-4.
What is the molecular formula of KST-1A5363?
The molecular formula of KST-1A5363 is C18H22N2O3S.
What is the molecular weight of KST-1A5363?
The molecular weight of KST-1A5363 is 346.14 g/mol.
Where can I buy KST-1A5363?
You can request a quote for KST-1A5363 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for KST-1A5363?
Yes, KEHONG BIO provides custom synthesis services for KST-1A5363 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.