Thioflavin T
TL;DR: Thioflavin T (CAS 2390-54-7) is a chemical compound with molecular formula C17H19ClN2S and molecular weight 318.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(3,6-dimethyl-1,3-benzothiazol-3-ium-2-yl)-N,N-dimethylaniline chloride
Also Known As: Thioflavin T, Thioflavine T, Basic yellow 1, Setoflavine T, Thioflavine S
| Molecular Formula | C17H19ClN2S |
|---|---|
| Molecular Weight | 318.10 g/mol |
| LogP | 0.77 |
| Topological Polar Surface Area | 35.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 318.09573 |
| Heavy Atoms | 21 |
| Complexity | 325.0 |
Chemical Identifiers
| CAS Number | 2390-54-7 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)[N+](=C(S2)C3=CC=C(C=C3)N(C)C)C.[Cl-] |
| InChIKey | JADVWWSKYZXRGX-UHFFFAOYSA-M |
Patent-Derived Application Labels
Derived from 21 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Thioflavin T (CAS 2390-54-7), with molecular formula C17H19ClN2S and molecular weight 318.10 g/mol. IUPAC: 4-(3,6-dimethyl-1,3-benzothiazol-3-ium-2-yl)-N,N-dimethylaniline chloride.
Chemical Property Profile of Thioflavin T
Property Insights of Thioflavin T
The XLogP value of 0.77 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Thioflavin T. With a topological polar surface area (TPSA) of 35.4 Ų, Thioflavin T exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Thioflavin T has 0 hydrogen bond donor(s) and 3 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 Thioflavin T?
The CAS number of Thioflavin T is 2390-54-7.
What is the molecular formula of Thioflavin T?
The molecular formula of Thioflavin T is C17H19ClN2S.
What is the molecular weight of Thioflavin T?
The molecular weight of Thioflavin T is 318.10 g/mol.
Where can I buy Thioflavin T?
You can request a quote for Thioflavin T directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Thioflavin T?
Yes, KEHONG BIO provides custom synthesis services for Thioflavin T and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.