Ethanol, 2-((2-chloro-3-benzo(b)thienyl)amino)-, S,S-dioxide
TL;DR: Ethanol, 2-((2-chloro-3-benzo(b)thienyl)amino)-, S,S-dioxide (CAS 52326-05-3) is a chemical compound with molecular formula C10H10ClNO3S and molecular weight 259.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2-chloro-1,1-dioxo-1-benzothiophen-3-yl)amino]ethanol
Also Known As: Ethanol, 2-((2-chloro-3-benzo(b)thienyl)amino)-, S,S-dioxide, 2-((2-Chloro-3-benzothienyl)amino)ethanol S,S-dioxide, 2-[(2-chloro-1,1-dioxo-1-benzothiophen-3-yl)amino]ethanol, 2-[(2-chloro-1,1-dioxido-1-benzothiophen-3-yl)amino]ethanol, Ethanol,2-((2-chloro-3-benzo(b)thienyl)amino)-,S,S-dioxide
| Molecular Formula | C10H10ClNO3S |
|---|---|
| Molecular Weight | 259.01 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 74.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 259.007 |
| Heavy Atoms | 16 |
| Complexity | 399.0 |
Chemical Identifiers
| CAS Number | 52326-05-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=C(S2(=O)=O)Cl)NCCO |
| InChIKey | ZWPBBNYLOBXNLX-UHFFFAOYSA-N |
Product Overview
Ethanol, 2-((2-chloro-3-benzo(b)thienyl)amino)-, S,S-dioxide (CAS 52326-05-3), with molecular formula C10H10ClNO3S and molecular weight 259.01 g/mol. IUPAC: 2-[(2-chloro-1,1-dioxo-1-benzothiophen-3-yl)amino]ethanol.
Chemical Property Profile of Ethanol, 2-((2-chloro-3-benzo(b)thienyl)amino)-, S,S-dioxide
Property Insights of Ethanol, 2-((2-chloro-3-benzo(b)thienyl)amino)-, S,S-dioxide
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethanol, 2-((2-chloro-3-benzo(b)thienyl)amino)-, S,S-dioxide. The TPSA of 74.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethanol, 2-((2-chloro-3-benzo(b)thienyl)amino)-, S,S-dioxide. Following Lipinski's Rule of Five, Ethanol, 2-((2-chloro-3-benzo(b)thienyl)amino)-, S,S-dioxide has 2 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 Ethanol, 2-((2-chloro-3-benzo(b)thienyl)amino)-, S,S-dioxide?
The CAS number of Ethanol, 2-((2-chloro-3-benzo(b)thienyl)amino)-, S,S-dioxide is 52326-05-3.
What is the molecular formula of Ethanol, 2-((2-chloro-3-benzo(b)thienyl)amino)-, S,S-dioxide?
The molecular formula of Ethanol, 2-((2-chloro-3-benzo(b)thienyl)amino)-, S,S-dioxide is C10H10ClNO3S.
What is the molecular weight of Ethanol, 2-((2-chloro-3-benzo(b)thienyl)amino)-, S,S-dioxide?
The molecular weight of Ethanol, 2-((2-chloro-3-benzo(b)thienyl)amino)-, S,S-dioxide is 259.01 g/mol.
Where can I buy Ethanol, 2-((2-chloro-3-benzo(b)thienyl)amino)-, S,S-dioxide?
You can request a quote for Ethanol, 2-((2-chloro-3-benzo(b)thienyl)amino)-, S,S-dioxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethanol, 2-((2-chloro-3-benzo(b)thienyl)amino)-, S,S-dioxide?
Yes, KEHONG BIO provides custom synthesis services for Ethanol, 2-((2-chloro-3-benzo(b)thienyl)amino)-, S,S-dioxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.