Benzo(b)thiophen-5-ol, 3-(2-aminoethyl)-
TL;DR: Benzo(b)thiophen-5-ol, 3-(2-aminoethyl)- (CAS 13012-93-6) 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.
3-(2-aminoethyl)-1-benzothiophen-5-ol
Also Known As: 3-(2-aminoethyl)-1-benzothiophen-5-ol, Benzothiophen-Isosteren, 3-(2-aminoethyl)-1-benzothiophene-5-ol, 3-(2-Aminoethyl)benzo(b)thiophen-5-ol, BENZO(b)THIOPHEN-5-OL, 3-(2-AMINOETHYL)-
| Molecular Formula | C10H11NOS |
|---|---|
| Molecular Weight | 193.06 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 74.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 193.05614 |
| Heavy Atoms | 13 |
| Complexity | 176.0 |
Chemical Identifiers
| CAS Number | 13012-93-6 |
|---|---|
| SMILES | C1=CC2=C(C=C1O)C(=CS2)CCN |
| InChIKey | ONTWCYDBNXHETF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzo(b)thiophen-5-ol, 3-(2-aminoethyl)- (CAS 13012-93-6), with molecular formula C10H11NOS and molecular weight 193.06 g/mol. IUPAC: 3-(2-aminoethyl)-1-benzothiophen-5-ol.
Chemical Property Profile of Benzo(b)thiophen-5-ol, 3-(2-aminoethyl)-
Property Insights of Benzo(b)thiophen-5-ol, 3-(2-aminoethyl)-
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzo(b)thiophen-5-ol, 3-(2-aminoethyl)-. The TPSA of 74.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzo(b)thiophen-5-ol, 3-(2-aminoethyl)-. Following Lipinski's Rule of Five, Benzo(b)thiophen-5-ol, 3-(2-aminoethyl)- has 2 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 Benzo(b)thiophen-5-ol, 3-(2-aminoethyl)-?
The CAS number of Benzo(b)thiophen-5-ol, 3-(2-aminoethyl)- is 13012-93-6.
What is the molecular formula of Benzo(b)thiophen-5-ol, 3-(2-aminoethyl)-?
The molecular formula of Benzo(b)thiophen-5-ol, 3-(2-aminoethyl)- is C10H11NOS.
What is the molecular weight of Benzo(b)thiophen-5-ol, 3-(2-aminoethyl)-?
The molecular weight of Benzo(b)thiophen-5-ol, 3-(2-aminoethyl)- is 193.06 g/mol.
Where can I buy Benzo(b)thiophen-5-ol, 3-(2-aminoethyl)-?
You can request a quote for Benzo(b)thiophen-5-ol, 3-(2-aminoethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzo(b)thiophen-5-ol, 3-(2-aminoethyl)-?
Yes, KEHONG BIO provides custom synthesis services for Benzo(b)thiophen-5-ol, 3-(2-aminoethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.