Benzothiazol-2-yl-phenyl-methanol
TL;DR: Benzothiazol-2-yl-phenyl-methanol (CAS 25927-64-4) is a chemical compound with molecular formula C14H11NOS and molecular weight 241.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-benzothiazol-2-yl(phenyl)methanol
Also Known As: Benzothiazol-2-yl-phenyl-methanol, 1,3-benzothiazol-2-yl(phenyl)methanol, ChemDiv2_000399, 2-Benzothiazolemethanol,a-phenyl-, 2-Benzothiazolylphenylmethanol
| Molecular Formula | C14H11NOS |
|---|---|
| Molecular Weight | 241.06 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 61.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 241.05614 |
| Heavy Atoms | 17 |
| Complexity | 255.0 |
Chemical Identifiers
| CAS Number | 25927-64-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(C2=NC3=CC=CC=C3S2)O |
| InChIKey | CIGCMDAWHHOUBO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzothiazol-2-yl-phenyl-methanol (CAS 25927-64-4), with molecular formula C14H11NOS and molecular weight 241.06 g/mol. IUPAC: 1,3-benzothiazol-2-yl(phenyl)methanol.
Chemical Property Profile of Benzothiazol-2-yl-phenyl-methanol
Property Insights of Benzothiazol-2-yl-phenyl-methanol
The XLogP value of 3.4 indicates that Benzothiazol-2-yl-phenyl-methanol 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 Benzothiazol-2-yl-phenyl-methanol. Following Lipinski's Rule of Five, Benzothiazol-2-yl-phenyl-methanol 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 Benzothiazol-2-yl-phenyl-methanol?
The CAS number of Benzothiazol-2-yl-phenyl-methanol is 25927-64-4.
What is the molecular formula of Benzothiazol-2-yl-phenyl-methanol?
The molecular formula of Benzothiazol-2-yl-phenyl-methanol is C14H11NOS.
What is the molecular weight of Benzothiazol-2-yl-phenyl-methanol?
The molecular weight of Benzothiazol-2-yl-phenyl-methanol is 241.06 g/mol.
Where can I buy Benzothiazol-2-yl-phenyl-methanol?
You can request a quote for Benzothiazol-2-yl-phenyl-methanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzothiazol-2-yl-phenyl-methanol?
Yes, KEHONG BIO provides custom synthesis services for Benzothiazol-2-yl-phenyl-methanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.