1-(1-Benzothiophen-3-yl)-2-(dibenzylamino)ethan-1-ol--hydrogen chloride (1/1)
TL;DR: 1-(1-Benzothiophen-3-yl)-2-(dibenzylamino)ethan-1-ol--hydrogen chloride (1/1) (CAS 7349-54-4) is a chemical compound with molecular formula C24H24ClNOS and molecular weight 409.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(1-benzothiophen-3-yl)-2-hydroxyethyl]-dibenzylazanium chloride
Also Known As: alpha-(Dibenzylaminomethyl)benzo(b)thiophene-3-methanol hydrochloride, BENZO(b)THIOPHENE-3-METHANOL, alpha-(DIBENZYLAMINOMETHYL)-, HYDROCHLORIDE, [2-(1-benzothiophen-3-yl)-2-hydroxyethyl]-dibenzylazanium chloride, 1-(1-Benzothiophen-3-yl)-2-(dibenzylamino)ethan-1-ol--hydrogen chloride (1/1), Benzo[b]thiophene-3-methanol, .alpha.-[[bis(phenylmethyl)amino]methyl]-, hydrochloride
| Molecular Formula | C24H24ClNOS |
|---|---|
| Molecular Weight | 409.13 g/mol |
| LogP | 1.22 |
| Topological Polar Surface Area | 52.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 409.1267 |
| Heavy Atoms | 28 |
| Complexity | 412.0 |
Chemical Identifiers
| CAS Number | 7349-54-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)C[NH+](CC2=CC=CC=C2)CC(C3=CSC4=CC=CC=C43)O.[Cl-] |
| InChIKey | UMGKGASRVZWTRM-UHFFFAOYSA-N |
Product Overview
1-(1-Benzothiophen-3-yl)-2-(dibenzylamino)ethan-1-ol--hydrogen chloride (1/1) (CAS 7349-54-4), with molecular formula C24H24ClNOS and molecular weight 409.13 g/mol. IUPAC: [2-(1-benzothiophen-3-yl)-2-hydroxyethyl]-dibenzylazanium chloride.
Chemical Property Profile of 1-(1-Benzothiophen-3-yl)-2-(dibenzylamino)ethan-1-ol--hydrogen chloride (1/1)
Property Insights of 1-(1-Benzothiophen-3-yl)-2-(dibenzylamino)ethan-1-ol--hydrogen chloride (1/1)
The XLogP value of 1.22 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(1-Benzothiophen-3-yl)-2-(dibenzylamino)ethan-1-ol--hydrogen chloride (1/1). With a topological polar surface area (TPSA) of 52.9 Ų, 1-(1-Benzothiophen-3-yl)-2-(dibenzylamino)ethan-1-ol--hydrogen chloride (1/1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(1-Benzothiophen-3-yl)-2-(dibenzylamino)ethan-1-ol--hydrogen chloride (1/1) 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 1-(1-Benzothiophen-3-yl)-2-(dibenzylamino)ethan-1-ol--hydrogen chloride (1/1)?
The CAS number of 1-(1-Benzothiophen-3-yl)-2-(dibenzylamino)ethan-1-ol--hydrogen chloride (1/1) is 7349-54-4.
What is the molecular formula of 1-(1-Benzothiophen-3-yl)-2-(dibenzylamino)ethan-1-ol--hydrogen chloride (1/1)?
The molecular formula of 1-(1-Benzothiophen-3-yl)-2-(dibenzylamino)ethan-1-ol--hydrogen chloride (1/1) is C24H24ClNOS.
What is the molecular weight of 1-(1-Benzothiophen-3-yl)-2-(dibenzylamino)ethan-1-ol--hydrogen chloride (1/1)?
The molecular weight of 1-(1-Benzothiophen-3-yl)-2-(dibenzylamino)ethan-1-ol--hydrogen chloride (1/1) is 409.13 g/mol.
Where can I buy 1-(1-Benzothiophen-3-yl)-2-(dibenzylamino)ethan-1-ol--hydrogen chloride (1/1)?
You can request a quote for 1-(1-Benzothiophen-3-yl)-2-(dibenzylamino)ethan-1-ol--hydrogen chloride (1/1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(1-Benzothiophen-3-yl)-2-(dibenzylamino)ethan-1-ol--hydrogen chloride (1/1)?
Yes, KEHONG BIO provides custom synthesis services for 1-(1-Benzothiophen-3-yl)-2-(dibenzylamino)ethan-1-ol--hydrogen chloride (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.