methanone structure](/static/products/6631/663186-54-7.webp)
[2-(Ethylsulfanyl)phenyl](pyrrolidin-1-yl)methanone
TL;DR: [2-(Ethylsulfanyl)phenyl](pyrrolidin-1-yl)methanone (CAS 663186-54-7) is a chemical compound with molecular formula C13H17NOS and molecular weight 235.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-ethylsulfanylphenyl)-pyrrolidin-1-ylmethanone
Also Known As: 1-[2-(ethylthio)benzoyl]pyrrolidine, 2-ethylthiophenyl pyrrolidinyl ketone, [2-(Ethylthio)phenyl]-1-pyrrolidinylmethanone, [2-(ethylsulfanyl)phenyl](pyrrolidin-1-yl)methanone, (2-ethylsulfanylphenyl)-pyrrolidin-1-ylmethanone
| Molecular Formula | C13H17NOS |
|---|---|
| Molecular Weight | 235.10 g/mol |
| LogP | 3.0346 |
| Topological Polar Surface Area | 20.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 235.10309 |
| Heavy Atoms | 16 |
| Complexity | 371.9503 |
Chemical Identifiers
| CAS Number | 663186-54-7 |
|---|---|
| SMILES | CCSC1=CC=CC=C1C(=O)N2CCCC2 |
Product Overview
[2-(Ethylsulfanyl)phenyl](pyrrolidin-1-yl)methanone (CAS 663186-54-7), with molecular formula C13H17NOS and molecular weight 235.10 g/mol. IUPAC: (2-ethylsulfanylphenyl)-pyrrolidin-1-ylmethanone.
Chemical Property Profile of [2-(Ethylsulfanyl)phenyl](pyrrolidin-1-yl)methanone
Property Insights of [2-(Ethylsulfanyl)phenyl](pyrrolidin-1-yl)methanone
The XLogP value of 3.0346 indicates that [2-(Ethylsulfanyl)phenyl](pyrrolidin-1-yl)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, [2-(Ethylsulfanyl)phenyl](pyrrolidin-1-yl)methanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [2-(Ethylsulfanyl)phenyl](pyrrolidin-1-yl)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 [2-(Ethylsulfanyl)phenyl](pyrrolidin-1-yl)methanone?
The CAS number of [2-(Ethylsulfanyl)phenyl](pyrrolidin-1-yl)methanone is 663186-54-7.
What is the molecular formula of [2-(Ethylsulfanyl)phenyl](pyrrolidin-1-yl)methanone?
The molecular formula of [2-(Ethylsulfanyl)phenyl](pyrrolidin-1-yl)methanone is C13H17NOS.
What is the molecular weight of [2-(Ethylsulfanyl)phenyl](pyrrolidin-1-yl)methanone?
The molecular weight of [2-(Ethylsulfanyl)phenyl](pyrrolidin-1-yl)methanone is 235.10 g/mol.
Where can I buy [2-(Ethylsulfanyl)phenyl](pyrrolidin-1-yl)methanone?
You can request a quote for [2-(Ethylsulfanyl)phenyl](pyrrolidin-1-yl)methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2-(Ethylsulfanyl)phenyl](pyrrolidin-1-yl)methanone?
Yes, KEHONG BIO provides custom synthesis services for [2-(Ethylsulfanyl)phenyl](pyrrolidin-1-yl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.