5-Chloro-2-phenylsulfanylindan-1-one
TL;DR: 5-Chloro-2-phenylsulfanylindan-1-one (CAS 500785-08-0) is a chemical compound with molecular formula C15H11ClOS and molecular weight 274.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-chloro-2-phenylsulfanyl-2,3-dihydroinden-1-one
Also Known As: 5-chloro-2-phenylsulfanylindan-1-one, 5-chloro-2-phenylsulfanyl-2,3-dihydroinden-1-one, 1H-Inden-1-one, 5-chloro-2,3-dihydro-2-(phenylthio)-, 5-Chloro-2-(phenylsulfanyl)-2,3-dihydro-1H-inden-1-one
| Molecular Formula | C15H11ClOS |
|---|---|
| Molecular Weight | 274.02 g/mol |
| LogP | 4.2397 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 274.0219 |
| Heavy Atoms | 18 |
| Complexity | 594.6975 |
Chemical Identifiers
| CAS Number | 500785-08-0 |
|---|---|
| SMILES | C1C(C(=O)C2=C1C=C(C=C2)Cl)SC3=CC=CC=C3 |
Product Overview
5-Chloro-2-phenylsulfanylindan-1-one (CAS 500785-08-0), with molecular formula C15H11ClOS and molecular weight 274.02 g/mol. IUPAC: 5-chloro-2-phenylsulfanyl-2,3-dihydroinden-1-one.
Chemical Property Profile of 5-Chloro-2-phenylsulfanylindan-1-one
Property Insights of 5-Chloro-2-phenylsulfanylindan-1-one
The XLogP value of 4.2397 indicates that 5-Chloro-2-phenylsulfanylindan-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.07 Ų, 5-Chloro-2-phenylsulfanylindan-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Chloro-2-phenylsulfanylindan-1-one 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 5-Chloro-2-phenylsulfanylindan-1-one?
The CAS number of 5-Chloro-2-phenylsulfanylindan-1-one is 500785-08-0.
What is the molecular formula of 5-Chloro-2-phenylsulfanylindan-1-one?
The molecular formula of 5-Chloro-2-phenylsulfanylindan-1-one is C15H11ClOS.
What is the molecular weight of 5-Chloro-2-phenylsulfanylindan-1-one?
The molecular weight of 5-Chloro-2-phenylsulfanylindan-1-one is 274.02 g/mol.
Where can I buy 5-Chloro-2-phenylsulfanylindan-1-one?
You can request a quote for 5-Chloro-2-phenylsulfanylindan-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Chloro-2-phenylsulfanylindan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 5-Chloro-2-phenylsulfanylindan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.