Benzo(c)thiophen-1(3H)-one, 3-((dimethylamino)phenylmethyl)-, (R*,S*)-
TL;DR: Benzo(c)thiophen-1(3H)-one, 3-((dimethylamino)phenylmethyl)-, (R*,S*)- (CAS 97874-56-1) 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.
(3S)-3-[(R)-dimethylamino(phenyl)methyl]-3H-2-benzothiophen-1-one
Also Known As: Benzo(c)thiophen-1(3H)-one, 3-((dimethylamino)phenylmethyl)-, (R*,S*)-, (R*,S*)-3-((Dimethylamino)phenylmethyl)benzo(c)thiophen-1(3H)-one, (3S)-3-[(R)-dimethylamino(phenyl)methyl]-3H-2-benzothiophen-1-one, (3S)-3-[(R)-(Dimethylamino)(phenyl)methyl]-2-benzothiophen-1(3H)-one, RefChem:326312
| Molecular Formula | C17H17NOS |
|---|---|
| Molecular Weight | 283.10 g/mol |
| LogP | 3.9176 |
| Topological Polar Surface Area | 20.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 283.1031 |
| Heavy Atoms | 20 |
| Complexity | 623.897 |
Chemical Identifiers
| CAS Number | 97874-56-1 |
|---|---|
| SMILES | CN(C)[C@@H]([C@@H]1C2=CC=CC=C2C(=O)S1)C3=CC=CC=C3 |
Product Overview
Benzo(c)thiophen-1(3H)-one, 3-((dimethylamino)phenylmethyl)-, (R*,S*)- (CAS 97874-56-1), with molecular formula C17H17NOS and molecular weight 283.10 g/mol. IUPAC: (3S)-3-[(R)-dimethylamino(phenyl)methyl]-3H-2-benzothiophen-1-one.
Chemical Property Profile of Benzo(c)thiophen-1(3H)-one, 3-((dimethylamino)phenylmethyl)-, (R*,S*)-
Property Insights of Benzo(c)thiophen-1(3H)-one, 3-((dimethylamino)phenylmethyl)-, (R*,S*)-
The XLogP value of 3.9176 indicates that Benzo(c)thiophen-1(3H)-one, 3-((dimethylamino)phenylmethyl)-, (R*,S*)- 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-((dimethylamino)phenylmethyl)-, (R*,S*)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzo(c)thiophen-1(3H)-one, 3-((dimethylamino)phenylmethyl)-, (R*,S*)- 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-((dimethylamino)phenylmethyl)-, (R*,S*)-?
The CAS number of Benzo(c)thiophen-1(3H)-one, 3-((dimethylamino)phenylmethyl)-, (R*,S*)- is 97874-56-1.
What is the molecular formula of Benzo(c)thiophen-1(3H)-one, 3-((dimethylamino)phenylmethyl)-, (R*,S*)-?
The molecular formula of Benzo(c)thiophen-1(3H)-one, 3-((dimethylamino)phenylmethyl)-, (R*,S*)- is C17H17NOS.
What is the molecular weight of Benzo(c)thiophen-1(3H)-one, 3-((dimethylamino)phenylmethyl)-, (R*,S*)-?
The molecular weight of Benzo(c)thiophen-1(3H)-one, 3-((dimethylamino)phenylmethyl)-, (R*,S*)- is 283.10 g/mol.
Where can I buy Benzo(c)thiophen-1(3H)-one, 3-((dimethylamino)phenylmethyl)-, (R*,S*)-?
You can request a quote for Benzo(c)thiophen-1(3H)-one, 3-((dimethylamino)phenylmethyl)-, (R*,S*)- 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-((dimethylamino)phenylmethyl)-, (R*,S*)-?
Yes, KEHONG BIO provides custom synthesis services for Benzo(c)thiophen-1(3H)-one, 3-((dimethylamino)phenylmethyl)-, (R*,S*)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.