(4-Fluoro-1-benzothiophen-2-yl)(1-pyrrolidinyl)methanone
TL;DR: (4-Fluoro-1-benzothiophen-2-yl)(1-pyrrolidinyl)methanone (CAS 866018-23-7) is a chemical compound with molecular formula C13H12FNOS and molecular weight 249.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-fluoro-1-benzothiophen-2-yl)-pyrrolidin-1-ylmethanone
Also Known As: (4-fluoro-1-benzothiophen-2-yl)(1-pyrrolidinyl)methanone, 1-(4-fluoro-1-benzothiophene-2-carbonyl)pyrrolidine, (4-fluoro-1-benzothiophen-2-yl)-pyrrolidin-1-ylmethanone, (4-fluorobenzothiophen-2-yl)-pyrrolidin-1-yl-methanone
| Molecular Formula | C13H12FNOS |
|---|---|
| Molecular Weight | 249.06 g/mol |
| LogP | 3.2764 |
| Topological Polar Surface Area | 20.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 249.06236 |
| Heavy Atoms | 17 |
| Complexity | 571.80316 |
Chemical Identifiers
| CAS Number | 866018-23-7 |
|---|---|
| SMILES | C1CCN(C1)C(=O)C2=CC3=C(C=CC=C3S2)F |
Product Overview
(4-Fluoro-1-benzothiophen-2-yl)(1-pyrrolidinyl)methanone (CAS 866018-23-7), with molecular formula C13H12FNOS and molecular weight 249.06 g/mol. IUPAC: (4-fluoro-1-benzothiophen-2-yl)-pyrrolidin-1-ylmethanone.
Chemical Property Profile of (4-Fluoro-1-benzothiophen-2-yl)(1-pyrrolidinyl)methanone
Property Insights of (4-Fluoro-1-benzothiophen-2-yl)(1-pyrrolidinyl)methanone
The XLogP value of 3.2764 indicates that (4-Fluoro-1-benzothiophen-2-yl)(1-pyrrolidinyl)methanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.31 Ų, (4-Fluoro-1-benzothiophen-2-yl)(1-pyrrolidinyl)methanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4-Fluoro-1-benzothiophen-2-yl)(1-pyrrolidinyl)methanone has 0 hydrogen bond donor(s) and 2 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 (4-Fluoro-1-benzothiophen-2-yl)(1-pyrrolidinyl)methanone?
The CAS number of (4-Fluoro-1-benzothiophen-2-yl)(1-pyrrolidinyl)methanone is 866018-23-7.
What is the molecular formula of (4-Fluoro-1-benzothiophen-2-yl)(1-pyrrolidinyl)methanone?
The molecular formula of (4-Fluoro-1-benzothiophen-2-yl)(1-pyrrolidinyl)methanone is C13H12FNOS.
What is the molecular weight of (4-Fluoro-1-benzothiophen-2-yl)(1-pyrrolidinyl)methanone?
The molecular weight of (4-Fluoro-1-benzothiophen-2-yl)(1-pyrrolidinyl)methanone is 249.06 g/mol.
Where can I buy (4-Fluoro-1-benzothiophen-2-yl)(1-pyrrolidinyl)methanone?
You can request a quote for (4-Fluoro-1-benzothiophen-2-yl)(1-pyrrolidinyl)methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-Fluoro-1-benzothiophen-2-yl)(1-pyrrolidinyl)methanone?
Yes, KEHONG BIO provides custom synthesis services for (4-Fluoro-1-benzothiophen-2-yl)(1-pyrrolidinyl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.