CTK8D5719
TL;DR: CTK8D5719 (CAS 34979-97-0) is a chemical compound with molecular formula C22H23N2O2S2+ and molecular weight 411.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-[3-[3-(2-hydroxyethyl)-1,3-benzothiazol-3-ium-2-yl]-2-methylprop-2-enylidene]-1,3-benzothiazol-3-yl]ethanol
Also Known As: 2-[2-[3-[3-(2-hydroxyethyl)-1,3-benzothiazol-3-ium-2-yl]-2-methylprop-2-enylidene]-1,3-benzothiazol-3-yl]ethanol, 3-(2-Hydroxy-ethyl)-2-{3-[3-(2-hydroxy-ethyl)-3H-benzothiazol-2-ylidene]-2-methyl-propenyl}-benzothiazol-3-ium, 3-(2-Hydroxyethyl)-2-{3-[3-(2-hydroxyethyl)-1,3-benzothiazol-2(3H)-ylidene]-2-methylprop-1-en-1-yl}-1,3-benzothiazol-3-ium
| Molecular Formula | C22H23N2O2S2+ |
|---|---|
| Molecular Weight | 411.12 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 101.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 411.1201 |
| Heavy Atoms | 28 |
| Complexity | 548.0 |
Chemical Identifiers
| CAS Number | 34979-97-0 |
|---|---|
| SMILES | CC(=CC1=[N+](C2=CC=CC=C2S1)CCO)C=C3N(C4=CC=CC=C4S3)CCO |
| InChIKey | AJKPVPNBPNCPLH-UHFFFAOYSA-N |
Product Overview
CTK8D5719 (CAS 34979-97-0), with molecular formula C22H23N2O2S2+ and molecular weight 411.12 g/mol. IUPAC: 2-[2-[3-[3-(2-hydroxyethyl)-1,3-benzothiazol-3-ium-2-yl]-2-methylprop-2-enylidene]-1,3-benzothiazol-3-yl]ethanol.
Chemical Property Profile of CTK8D5719
Property Insights of CTK8D5719
The XLogP value of 4.8 indicates that CTK8D5719 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for CTK8D5719. Following Lipinski's Rule of Five, CTK8D5719 has 2 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 CTK8D5719?
The CAS number of CTK8D5719 is 34979-97-0.
What is the molecular formula of CTK8D5719?
The molecular formula of CTK8D5719 is C22H23N2O2S2+.
What is the molecular weight of CTK8D5719?
The molecular weight of CTK8D5719 is 411.12 g/mol.
Where can I buy CTK8D5719?
You can request a quote for CTK8D5719 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CTK8D5719?
Yes, KEHONG BIO provides custom synthesis services for CTK8D5719 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.