KST-1A9009
TL;DR: KST-1A9009 (CAS 93376-90-0) is a chemical compound with molecular formula C15H13NO4S2 and molecular weight 335.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-[(Z)-(4-oxo-3-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenoxy]acetic acid
Also Known As: KST-1A9009, 3-amino-2'-hydroxy-trans-chalcone, 2-[2-[(Z)-(4-oxo-3-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenoxy]acetic acid, (2-{[4-oxo-3-(prop-2-en-1-yl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}phenoxy)acetic acid, 2-[2-[(4-oxo-3-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenoxy]acetic acid
| Molecular Formula | C15H13NO4S2 |
|---|---|
| Molecular Weight | 335.03 g/mol |
| LogP | 2.5372 |
| Topological Polar Surface Area | 66.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 335.0286 |
| Heavy Atoms | 22 |
| Complexity | 669.2612 |
Chemical Identifiers
| CAS Number | 93376-90-0 |
|---|---|
| SMILES | C=CCN1C(=O)/C(=C/C2=CC=CC=C2OCC(=O)O)/SC1=S |
Product Overview
KST-1A9009 (CAS 93376-90-0), with molecular formula C15H13NO4S2 and molecular weight 335.03 g/mol. IUPAC: 2-[2-[(Z)-(4-oxo-3-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenoxy]acetic acid.
Chemical Property Profile of KST-1A9009
Property Insights of KST-1A9009
The XLogP value of 2.5372 suggests moderate lipophilicity, balancing water solubility and membrane permeability for KST-1A9009. The TPSA of 66.84 Ų falls within the moderate polarity range, balancing permeability and solubility for KST-1A9009. Following Lipinski's Rule of Five, KST-1A9009 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-1A9009?
The CAS number of KST-1A9009 is 93376-90-0.
What is the molecular formula of KST-1A9009?
The molecular formula of KST-1A9009 is C15H13NO4S2.
What is the molecular weight of KST-1A9009?
The molecular weight of KST-1A9009 is 335.03 g/mol.
Where can I buy KST-1A9009?
You can request a quote for KST-1A9009 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for KST-1A9009?
Yes, KEHONG BIO provides custom synthesis services for KST-1A9009 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.