Benzo(c)thiophen-1(3H)-one, 3-((methyl(phenylmethyl)amino)methyl)-
TL;DR: Benzo(c)thiophen-1(3H)-one, 3-((methyl(phenylmethyl)amino)methyl)- (CAS 97874-31-2) is a chemical compound with molecular formula C17H17NOS and molecular weight 283.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[benzyl(methyl)amino]methyl]-3H-2-benzothiophen-1-one
Also Known As: 3-((Methyl(phenylmethyl)amino)methyl)benzo(c)thiophen-1(3H)-one, 3-[[benzyl(methyl)amino]methyl]-3H-2-benzothiophen-1-one, Benzo(c)thiophen-1(3H)-one, 3-((methyl(phenylmethyl)amino)methyl)-, 3-{[Benzyl(methyl)amino]methyl}-2-benzothiophen-1(3H)-one, 9-[ methyl]-8-thiabicyclo[4.3.0]nona-1,3,5-trien-7-one
| Molecular Formula | C17H17NOS |
|---|---|
| Molecular Weight | 283.10 g/mol |
| LogP | 3.7467 |
| Topological Polar Surface Area | 20.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 283.1031 |
| Heavy Atoms | 20 |
| Complexity | 611.3969 |
Chemical Identifiers
| CAS Number | 97874-31-2 |
|---|---|
| SMILES | CN(CC1C2=CC=CC=C2C(=O)S1)CC3=CC=CC=C3 |
Product Overview
Benzo(c)thiophen-1(3H)-one, 3-((methyl(phenylmethyl)amino)methyl)- (CAS 97874-31-2), with molecular formula C17H17NOS and molecular weight 283.10 g/mol. IUPAC: 3-[[benzyl(methyl)amino]methyl]-3H-2-benzothiophen-1-one.
Chemical Property Profile of Benzo(c)thiophen-1(3H)-one, 3-((methyl(phenylmethyl)amino)methyl)-
Property Insights of Benzo(c)thiophen-1(3H)-one, 3-((methyl(phenylmethyl)amino)methyl)-
The XLogP value of 3.7467 indicates that Benzo(c)thiophen-1(3H)-one, 3-((methyl(phenylmethyl)amino)methyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.31 Ų, Benzo(c)thiophen-1(3H)-one, 3-((methyl(phenylmethyl)amino)methyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzo(c)thiophen-1(3H)-one, 3-((methyl(phenylmethyl)amino)methyl)- has 0 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(c)thiophen-1(3H)-one, 3-((methyl(phenylmethyl)amino)methyl)-?
The CAS number of Benzo(c)thiophen-1(3H)-one, 3-((methyl(phenylmethyl)amino)methyl)- is 97874-31-2.
What is the molecular formula of Benzo(c)thiophen-1(3H)-one, 3-((methyl(phenylmethyl)amino)methyl)-?
The molecular formula of Benzo(c)thiophen-1(3H)-one, 3-((methyl(phenylmethyl)amino)methyl)- is C17H17NOS.
What is the molecular weight of Benzo(c)thiophen-1(3H)-one, 3-((methyl(phenylmethyl)amino)methyl)-?
The molecular weight of Benzo(c)thiophen-1(3H)-one, 3-((methyl(phenylmethyl)amino)methyl)- is 283.10 g/mol.
Where can I buy Benzo(c)thiophen-1(3H)-one, 3-((methyl(phenylmethyl)amino)methyl)-?
You can request a quote for Benzo(c)thiophen-1(3H)-one, 3-((methyl(phenylmethyl)amino)methyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzo(c)thiophen-1(3H)-one, 3-((methyl(phenylmethyl)amino)methyl)-?
Yes, KEHONG BIO provides custom synthesis services for Benzo(c)thiophen-1(3H)-one, 3-((methyl(phenylmethyl)amino)methyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.