1-(1,3-Benzothiazol-2-yl)ethan-1-ol
TL;DR: 1-(1,3-Benzothiazol-2-yl)ethan-1-ol (CAS 1059697-82-3) is a chemical compound with molecular formula C9H9NOS and molecular weight 179.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1,3-benzothiazol-2-yl)ethanol
Also Known As: 1-(1,3-benzothiazol-2-yl)ethanol, 1-(Benzo[d]thiazol-2-yl)ethanol, 1-(1,3-benzothiazol-2-yl)ethan-1-ol, 1-(2-benzothiazolyl)ethanol, 1-benzothiazol-2-yl-ethanol
| Molecular Formula | C9H9NOS |
|---|---|
| Molecular Weight | 179.04 g/mol |
| LogP | 2.3496 |
| Topological Polar Surface Area | 33.12 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 179.04048 |
| Heavy Atoms | 12 |
| Complexity | 361.0828 |
Chemical Identifiers
| CAS Number | 1059697-82-3 |
|---|---|
| SMILES | CC(C1=NC2=CC=CC=C2S1)O |
Product Overview
1-(1,3-Benzothiazol-2-yl)ethan-1-ol (CAS 1059697-82-3), with molecular formula C9H9NOS and molecular weight 179.04 g/mol. IUPAC: 1-(1,3-benzothiazol-2-yl)ethanol.
Chemical Property Profile of 1-(1,3-Benzothiazol-2-yl)ethan-1-ol
Property Insights of 1-(1,3-Benzothiazol-2-yl)ethan-1-ol
The XLogP value of 2.3496 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(1,3-Benzothiazol-2-yl)ethan-1-ol. With a topological polar surface area (TPSA) of 33.12 Ų, 1-(1,3-Benzothiazol-2-yl)ethan-1-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(1,3-Benzothiazol-2-yl)ethan-1-ol 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 1-(1,3-Benzothiazol-2-yl)ethan-1-ol?
The CAS number of 1-(1,3-Benzothiazol-2-yl)ethan-1-ol is 1059697-82-3.
What is the molecular formula of 1-(1,3-Benzothiazol-2-yl)ethan-1-ol?
The molecular formula of 1-(1,3-Benzothiazol-2-yl)ethan-1-ol is C9H9NOS.
What is the molecular weight of 1-(1,3-Benzothiazol-2-yl)ethan-1-ol?
The molecular weight of 1-(1,3-Benzothiazol-2-yl)ethan-1-ol is 179.04 g/mol.
Where can I buy 1-(1,3-Benzothiazol-2-yl)ethan-1-ol?
You can request a quote for 1-(1,3-Benzothiazol-2-yl)ethan-1-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(1,3-Benzothiazol-2-yl)ethan-1-ol?
Yes, KEHONG BIO provides custom synthesis services for 1-(1,3-Benzothiazol-2-yl)ethan-1-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.