2-(2-Methyl-1,3-benzothiazol-5-yl)ethanol
TL;DR: 2-(2-Methyl-1,3-benzothiazol-5-yl)ethanol (CAS 3921-06-0) is a chemical compound with molecular formula C10H11NOS and molecular weight 193.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-methyl-1,3-benzothiazol-5-yl)ethanol
Also Known As: ChemDiv3_014799, 5-benzothiazoleethanol,2-methyl-, 5-Benzothiazoleethanol, 2-methyl-, 2-(2-Methyl-1,3-benzothiazol-5-yl)ethanol, Ethanol, 2-(2-methyl-5-benzothiazolyl)-
| Molecular Formula | C10H11NOS |
|---|---|
| Molecular Weight | 193.06 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 61.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 193.05614 |
| Heavy Atoms | 13 |
| Complexity | 176.0 |
Chemical Identifiers
| CAS Number | 3921-06-0 |
|---|---|
| SMILES | CC1=NC2=C(S1)C=CC(=C2)CCO |
| InChIKey | LMONEXCPVOBHAU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(2-Methyl-1,3-benzothiazol-5-yl)ethanol (CAS 3921-06-0), with molecular formula C10H11NOS and molecular weight 193.06 g/mol. IUPAC: 2-(2-methyl-1,3-benzothiazol-5-yl)ethanol.
Chemical Property Profile of 2-(2-Methyl-1,3-benzothiazol-5-yl)ethanol
Property Insights of 2-(2-Methyl-1,3-benzothiazol-5-yl)ethanol
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2-Methyl-1,3-benzothiazol-5-yl)ethanol. The TPSA of 61.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2-Methyl-1,3-benzothiazol-5-yl)ethanol. Following Lipinski's Rule of Five, 2-(2-Methyl-1,3-benzothiazol-5-yl)ethanol 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 2-(2-Methyl-1,3-benzothiazol-5-yl)ethanol?
The CAS number of 2-(2-Methyl-1,3-benzothiazol-5-yl)ethanol is 3921-06-0.
What is the molecular formula of 2-(2-Methyl-1,3-benzothiazol-5-yl)ethanol?
The molecular formula of 2-(2-Methyl-1,3-benzothiazol-5-yl)ethanol is C10H11NOS.
What is the molecular weight of 2-(2-Methyl-1,3-benzothiazol-5-yl)ethanol?
The molecular weight of 2-(2-Methyl-1,3-benzothiazol-5-yl)ethanol is 193.06 g/mol.
Where can I buy 2-(2-Methyl-1,3-benzothiazol-5-yl)ethanol?
You can request a quote for 2-(2-Methyl-1,3-benzothiazol-5-yl)ethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-Methyl-1,3-benzothiazol-5-yl)ethanol?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Methyl-1,3-benzothiazol-5-yl)ethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.