Benzo(b)thiophene-3-methanol, alpha-(pyrrolidinomethyl)-, hydrochloride
TL;DR: Benzo(b)thiophene-3-methanol, alpha-(pyrrolidinomethyl)-, hydrochloride (CAS 7349-53-3) is a chemical compound with molecular formula C14H18ClNOS and molecular weight 283.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1-benzothiophen-3-yl)-2-pyrrolidin-1-ium-1-ylethanol chloride
Also Known As: alpha-(Pyrrolidinomethyl)benzo(b)thiophene-3-methanol hydrochloride, BENZO(b)THIOPHENE-3-METHANOL, alpha-(PYRROLIDINOMETHYL)-, HYDROCHLORIDE, 1-(1-benzothiophen-3-yl)-2-pyrrolidin-1-ium-1-ylethanol chloride, 1-Pyrrolidineethanol, .alpha.-benzo[b]thien-3-yl-, hydrochloride, RefChem:1078833
| Molecular Formula | C14H18ClNOS |
|---|---|
| Molecular Weight | 283.08 g/mol |
| LogP | -1.38 |
| Topological Polar Surface Area | 52.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 283.07977 |
| Heavy Atoms | 18 |
| Complexity | 255.0 |
Chemical Identifiers
| CAS Number | 7349-53-3 |
|---|---|
| SMILES | C1CC[NH+](C1)CC(C2=CSC3=CC=CC=C32)O.[Cl-] |
| InChIKey | SAKBAKAJNGBCMG-UHFFFAOYSA-N |
Product Overview
Benzo(b)thiophene-3-methanol, alpha-(pyrrolidinomethyl)-, hydrochloride (CAS 7349-53-3), with molecular formula C14H18ClNOS and molecular weight 283.08 g/mol. IUPAC: 1-(1-benzothiophen-3-yl)-2-pyrrolidin-1-ium-1-ylethanol chloride.
Chemical Property Profile of Benzo(b)thiophene-3-methanol, alpha-(pyrrolidinomethyl)-, hydrochloride
Property Insights of Benzo(b)thiophene-3-methanol, alpha-(pyrrolidinomethyl)-, hydrochloride
The XLogP value of -1.38 indicates that Benzo(b)thiophene-3-methanol, alpha-(pyrrolidinomethyl)-, hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 52.9 Ų, Benzo(b)thiophene-3-methanol, alpha-(pyrrolidinomethyl)-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzo(b)thiophene-3-methanol, alpha-(pyrrolidinomethyl)-, 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 Benzo(b)thiophene-3-methanol, alpha-(pyrrolidinomethyl)-, hydrochloride?
The CAS number of Benzo(b)thiophene-3-methanol, alpha-(pyrrolidinomethyl)-, hydrochloride is 7349-53-3.
What is the molecular formula of Benzo(b)thiophene-3-methanol, alpha-(pyrrolidinomethyl)-, hydrochloride?
The molecular formula of Benzo(b)thiophene-3-methanol, alpha-(pyrrolidinomethyl)-, hydrochloride is C14H18ClNOS.
What is the molecular weight of Benzo(b)thiophene-3-methanol, alpha-(pyrrolidinomethyl)-, hydrochloride?
The molecular weight of Benzo(b)thiophene-3-methanol, alpha-(pyrrolidinomethyl)-, hydrochloride is 283.08 g/mol.
Where can I buy Benzo(b)thiophene-3-methanol, alpha-(pyrrolidinomethyl)-, hydrochloride?
You can request a quote for Benzo(b)thiophene-3-methanol, alpha-(pyrrolidinomethyl)-, 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-methanol, alpha-(pyrrolidinomethyl)-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Benzo(b)thiophene-3-methanol, alpha-(pyrrolidinomethyl)-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.