Benzo(b)thiophene-3-methylamine, N-benzyl-N-(2-chloroethyl)-, hydrochloride
TL;DR: Benzo(b)thiophene-3-methylamine, N-benzyl-N-(2-chloroethyl)-, hydrochloride (CAS 16662-22-9) is a chemical compound with molecular formula C18H19Cl2NS and molecular weight 351.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1-benzothiophen-3-ylmethyl)-N-benzyl-2-chloroethanamine;hydrochloride
Also Known As: Benzo(b)thiophene-3-methylamine, N-benzyl-N-(2-chloroethyl)-, hydrochloride, N-Benzyl-N-(2-chloroethyl)benzo(b)thiophene-3-methylamine hydrochloride, N-(1-benzothiophen-3-ylmethyl)-N-benzyl-2-chloroethanamine hydrochloride, N-[(1-Benzothiophen-3-yl)methyl]-N-benzyl-2-chloroethan-1-amine--hydrogen chloride (1/1), RefChem:326269
| Molecular Formula | C18H19Cl2NS |
|---|---|
| Molecular Weight | 351.06 g/mol |
| LogP | 5.5641 |
| Topological Polar Surface Area | 31.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 351.06152 |
| Heavy Atoms | 22 |
| Complexity | 306.0 |
Chemical Identifiers
| CAS Number | 16662-22-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)CN(CCCl)CC2=CSC3=CC=CC=C32.Cl |
| InChIKey | FRRIWFKVJDUAMR-UHFFFAOYSA-N |
Product Overview
Benzo(b)thiophene-3-methylamine, N-benzyl-N-(2-chloroethyl)-, hydrochloride (CAS 16662-22-9), with molecular formula C18H19Cl2NS and molecular weight 351.06 g/mol. IUPAC: N-(1-benzothiophen-3-ylmethyl)-N-benzyl-2-chloroethanamine;hydrochloride.
Chemical Property Profile of Benzo(b)thiophene-3-methylamine, N-benzyl-N-(2-chloroethyl)-, hydrochloride
Property Insights of Benzo(b)thiophene-3-methylamine, N-benzyl-N-(2-chloroethyl)-, hydrochloride
The XLogP value of 5.5641 indicates that Benzo(b)thiophene-3-methylamine, N-benzyl-N-(2-chloroethyl)-, hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 31.5 Ų, Benzo(b)thiophene-3-methylamine, N-benzyl-N-(2-chloroethyl)-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzo(b)thiophene-3-methylamine, N-benzyl-N-(2-chloroethyl)-, hydrochloride has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Benzo(b)thiophene-3-methylamine, N-benzyl-N-(2-chloroethyl)-, hydrochloride?
The CAS number of Benzo(b)thiophene-3-methylamine, N-benzyl-N-(2-chloroethyl)-, hydrochloride is 16662-22-9.
What is the molecular formula of Benzo(b)thiophene-3-methylamine, N-benzyl-N-(2-chloroethyl)-, hydrochloride?
The molecular formula of Benzo(b)thiophene-3-methylamine, N-benzyl-N-(2-chloroethyl)-, hydrochloride is C18H19Cl2NS.
What is the molecular weight of Benzo(b)thiophene-3-methylamine, N-benzyl-N-(2-chloroethyl)-, hydrochloride?
The molecular weight of Benzo(b)thiophene-3-methylamine, N-benzyl-N-(2-chloroethyl)-, hydrochloride is 351.06 g/mol.
Where can I buy Benzo(b)thiophene-3-methylamine, N-benzyl-N-(2-chloroethyl)-, hydrochloride?
You can request a quote for Benzo(b)thiophene-3-methylamine, N-benzyl-N-(2-chloroethyl)-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzo(b)thiophene-3-methylamine, N-benzyl-N-(2-chloroethyl)-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Benzo(b)thiophene-3-methylamine, N-benzyl-N-(2-chloroethyl)-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.