Ethanol, 1-(5-bromo-2-thienyl)-2-isopropylamino-, hydrochloride
TL;DR: Ethanol, 1-(5-bromo-2-thienyl)-2-isopropylamino-, hydrochloride (CAS 57681-86-4) is a chemical compound with molecular formula C9H15BrClNOS and molecular weight 298.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(5-bromothiophen-2-yl)-2-(propan-2-ylamino)ethanol;hydrochloride
Also Known As: 1-(5-Bromo-2-thienyl)-2-isopropylaminoethanol hydrochloride, Ethanol, 1-(5-bromo-2-thienyl)-2-isopropylamino-, hydrochloride, 5-Bromo-alpha-(isopropylaminomethyl)-2-thiophenemethanol hydrochloride, 2-Thiophenemethanol, 5-bromo-alpha-(isopropylaminomethyl)-, hydrochloride, 1-(5-bromothiophen-2-yl)-2-(propan-2-ylamino)ethanol hydrochloride
| Molecular Formula | C9H15BrClNOS |
|---|---|
| Molecular Weight | 298.97 g/mol |
| LogP | 2.9638 |
| Topological Polar Surface Area | 32.26 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 298.97464 |
| Heavy Atoms | 14 |
| Complexity | 267.06955 |
Chemical Identifiers
| CAS Number | 57681-86-4 |
|---|---|
| SMILES | CC(C)NCC(C1=CC=C(S1)Br)O.Cl |
Product Overview
Ethanol, 1-(5-bromo-2-thienyl)-2-isopropylamino-, hydrochloride (CAS 57681-86-4), with molecular formula C9H15BrClNOS and molecular weight 298.97 g/mol. IUPAC: 1-(5-bromothiophen-2-yl)-2-(propan-2-ylamino)ethanol;hydrochloride.
Chemical Property Profile of Ethanol, 1-(5-bromo-2-thienyl)-2-isopropylamino-, hydrochloride
Property Insights of Ethanol, 1-(5-bromo-2-thienyl)-2-isopropylamino-, hydrochloride
The XLogP value of 2.9638 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethanol, 1-(5-bromo-2-thienyl)-2-isopropylamino-, hydrochloride. With a topological polar surface area (TPSA) of 32.26 Ų, Ethanol, 1-(5-bromo-2-thienyl)-2-isopropylamino-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethanol, 1-(5-bromo-2-thienyl)-2-isopropylamino-, hydrochloride 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 Ethanol, 1-(5-bromo-2-thienyl)-2-isopropylamino-, hydrochloride?
The CAS number of Ethanol, 1-(5-bromo-2-thienyl)-2-isopropylamino-, hydrochloride is 57681-86-4.
What is the molecular formula of Ethanol, 1-(5-bromo-2-thienyl)-2-isopropylamino-, hydrochloride?
The molecular formula of Ethanol, 1-(5-bromo-2-thienyl)-2-isopropylamino-, hydrochloride is C9H15BrClNOS.
What is the molecular weight of Ethanol, 1-(5-bromo-2-thienyl)-2-isopropylamino-, hydrochloride?
The molecular weight of Ethanol, 1-(5-bromo-2-thienyl)-2-isopropylamino-, hydrochloride is 298.97 g/mol.
Where can I buy Ethanol, 1-(5-bromo-2-thienyl)-2-isopropylamino-, hydrochloride?
You can request a quote for Ethanol, 1-(5-bromo-2-thienyl)-2-isopropylamino-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethanol, 1-(5-bromo-2-thienyl)-2-isopropylamino-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Ethanol, 1-(5-bromo-2-thienyl)-2-isopropylamino-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.