2-(2-Benzothiazolyl)-5-methoxyphenol
TL;DR: 2-(2-Benzothiazolyl)-5-methoxyphenol (CAS 90481-46-2) is a chemical compound with molecular formula C14H11NO2S and molecular weight 257.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-benzothiazol-2-yl)-5-methoxyphenol
Also Known As: 2-(2-Benzothiazolyl)-5-methoxyphenol, 2- -5-methoxyphenol, 2-(1,3-Benzothiazol-2-yl)-5-methoxyphenol, 2-(BENZO[D]THIAZOL-2-YL)-5-METHOXYPHENOL, 2-(2-Hydroxy-4-methoxyphenyl)benzothiazole
| Molecular Formula | C14H11NO2S |
|---|---|
| Molecular Weight | 257.05 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 70.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 257.05106 |
| Heavy Atoms | 18 |
| Complexity | 289.0 |
Chemical Identifiers
| CAS Number | 90481-46-2 |
|---|---|
| SMILES | COC1=CC(=C(C=C1)C2=NC3=CC=CC=C3S2)O |
| InChIKey | KQUJPMLQKNTPCL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(2-Benzothiazolyl)-5-methoxyphenol (CAS 90481-46-2), with molecular formula C14H11NO2S and molecular weight 257.05 g/mol. IUPAC: 2-(1,3-benzothiazol-2-yl)-5-methoxyphenol.
Chemical Property Profile of 2-(2-Benzothiazolyl)-5-methoxyphenol
Property Insights of 2-(2-Benzothiazolyl)-5-methoxyphenol
The XLogP value of 3.9 indicates that 2-(2-Benzothiazolyl)-5-methoxyphenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2-Benzothiazolyl)-5-methoxyphenol. Following Lipinski's Rule of Five, 2-(2-Benzothiazolyl)-5-methoxyphenol has 1 hydrogen bond donor(s) and 4 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 2-(2-Benzothiazolyl)-5-methoxyphenol?
The CAS number of 2-(2-Benzothiazolyl)-5-methoxyphenol is 90481-46-2.
What is the molecular formula of 2-(2-Benzothiazolyl)-5-methoxyphenol?
The molecular formula of 2-(2-Benzothiazolyl)-5-methoxyphenol is C14H11NO2S.
What is the molecular weight of 2-(2-Benzothiazolyl)-5-methoxyphenol?
The molecular weight of 2-(2-Benzothiazolyl)-5-methoxyphenol is 257.05 g/mol.
Where can I buy 2-(2-Benzothiazolyl)-5-methoxyphenol?
You can request a quote for 2-(2-Benzothiazolyl)-5-methoxyphenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-Benzothiazolyl)-5-methoxyphenol?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Benzothiazolyl)-5-methoxyphenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.