Benzothiazolyl-beta-naphthol
TL;DR: Benzothiazolyl-beta-naphthol (CAS 6344-18-9) is a chemical compound with molecular formula C17H11NOS and molecular weight 277.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1,3-benzothiazol-2-yl)naphthalen-2-ol
Also Known As: benzothiazolyl-beta-naphthol, 1-(2-Benzothiazolyl)-2-naphthol, 1-(Benzothiazole-2-yl)-2-naphthol, 1-(benzo[d]thiazol-2-yl)naphthalen-2-ol, 1-(1,3-benzothiazol-2-yl)naphthalen-2-ol
| Molecular Formula | C17H11NOS |
|---|---|
| Molecular Weight | 277.06 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 61.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 277.05612 |
| Heavy Atoms | 20 |
| Complexity | 350.0 |
Chemical Identifiers
| CAS Number | 6344-18-9 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC(=C2C3=NC4=CC=CC=C4S3)O |
| InChIKey | VMCVUGJRJCPOFK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzothiazolyl-beta-naphthol (CAS 6344-18-9), with molecular formula C17H11NOS and molecular weight 277.06 g/mol. IUPAC: 1-(1,3-benzothiazol-2-yl)naphthalen-2-ol.
Chemical Property Profile of Benzothiazolyl-beta-naphthol
Property Insights of Benzothiazolyl-beta-naphthol
The XLogP value of 4.9 indicates that Benzothiazolyl-beta-naphthol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzothiazolyl-beta-naphthol. Following Lipinski's Rule of Five, Benzothiazolyl-beta-naphthol has 1 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 Benzothiazolyl-beta-naphthol?
The CAS number of Benzothiazolyl-beta-naphthol is 6344-18-9.
What is the molecular formula of Benzothiazolyl-beta-naphthol?
The molecular formula of Benzothiazolyl-beta-naphthol is C17H11NOS.
What is the molecular weight of Benzothiazolyl-beta-naphthol?
The molecular weight of Benzothiazolyl-beta-naphthol is 277.06 g/mol.
Where can I buy Benzothiazolyl-beta-naphthol?
You can request a quote for Benzothiazolyl-beta-naphthol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzothiazolyl-beta-naphthol?
Yes, KEHONG BIO provides custom synthesis services for Benzothiazolyl-beta-naphthol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.