Ketone, benzo(b)thien-3-yl piperidinomethyl, hydrochloride
TL;DR: Ketone, benzo(b)thien-3-yl piperidinomethyl, hydrochloride (CAS 7349-48-6) is a chemical compound with molecular formula C15H18ClNOS and molecular weight 295.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1-benzothiophen-3-yl)-2-piperidin-1-ium-1-ylethanone chloride
Also Known As: Benzo(b)thien-3-yl piperidinomethyl ketone hydrochloride, 3-(Piperidinoacetyl)benzo(b)thiophene hydrochloride, Benzo(b)thiophene, 3-(piperidinoacetyl)-, hydrochloride, KETONE, BENZO(b)THIEN-3-YL PIPERIDINOMETHYL, HYDROCHLORIDE, 1-(1-benzothiophen-3-yl)-2-piperidin-1-ium-1-ylethanone chloride
| Molecular Formula | C15H18ClNOS |
|---|---|
| Molecular Weight | 295.08 g/mol |
| LogP | -0.84 |
| Topological Polar Surface Area | 49.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 295.07977 |
| Heavy Atoms | 19 |
| Complexity | 301.0 |
Chemical Identifiers
| CAS Number | 7349-48-6 |
|---|---|
| SMILES | C1CC[NH+](CC1)CC(=O)C2=CSC3=CC=CC=C32.[Cl-] |
| InChIKey | MSEIVYRGQGGLDG-UHFFFAOYSA-N |
Product Overview
Ketone, benzo(b)thien-3-yl piperidinomethyl, hydrochloride (CAS 7349-48-6), with molecular formula C15H18ClNOS and molecular weight 295.08 g/mol. IUPAC: 1-(1-benzothiophen-3-yl)-2-piperidin-1-ium-1-ylethanone chloride.
Chemical Property Profile of Ketone, benzo(b)thien-3-yl piperidinomethyl, hydrochloride
Property Insights of Ketone, benzo(b)thien-3-yl piperidinomethyl, hydrochloride
The XLogP value of -0.84 indicates that Ketone, benzo(b)thien-3-yl piperidinomethyl, hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 49.8 Ų, Ketone, benzo(b)thien-3-yl piperidinomethyl, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ketone, benzo(b)thien-3-yl piperidinomethyl, hydrochloride has 1 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 Ketone, benzo(b)thien-3-yl piperidinomethyl, hydrochloride?
The CAS number of Ketone, benzo(b)thien-3-yl piperidinomethyl, hydrochloride is 7349-48-6.
What is the molecular formula of Ketone, benzo(b)thien-3-yl piperidinomethyl, hydrochloride?
The molecular formula of Ketone, benzo(b)thien-3-yl piperidinomethyl, hydrochloride is C15H18ClNOS.
What is the molecular weight of Ketone, benzo(b)thien-3-yl piperidinomethyl, hydrochloride?
The molecular weight of Ketone, benzo(b)thien-3-yl piperidinomethyl, hydrochloride is 295.08 g/mol.
Where can I buy Ketone, benzo(b)thien-3-yl piperidinomethyl, hydrochloride?
You can request a quote for Ketone, benzo(b)thien-3-yl piperidinomethyl, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ketone, benzo(b)thien-3-yl piperidinomethyl, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Ketone, benzo(b)thien-3-yl piperidinomethyl, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.