4-Phenyl-5,5,5-tris(phenylsulfanyl)pentan-2-one
TL;DR: 4-Phenyl-5,5,5-tris(phenylsulfanyl)pentan-2-one (CAS 56003-68-0) is a chemical compound with molecular formula C29H26OS3 and molecular weight 486.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-phenyl-5,5,5-tris(phenylsulfanyl)pentan-2-one
Also Known As: 4-phenyl-5,5,5-tris(phenylsulfanyl)pentan-2-one
| Molecular Formula | C29H26OS3 |
|---|---|
| Molecular Weight | 486.11 g/mol |
| LogP | 8.3 |
| Topological Polar Surface Area | 93.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 486.1146 |
| Heavy Atoms | 33 |
| Complexity | 519.0 |
Chemical Identifiers
| CAS Number | 56003-68-0 |
|---|---|
| SMILES | CC(=O)CC(C1=CC=CC=C1)C(SC2=CC=CC=C2)(SC3=CC=CC=C3)SC4=CC=CC=C4 |
| InChIKey | KQHUEKLRQQYRMB-UHFFFAOYSA-N |
Product Overview
4-Phenyl-5,5,5-tris(phenylsulfanyl)pentan-2-one (CAS 56003-68-0), with molecular formula C29H26OS3 and molecular weight 486.11 g/mol. IUPAC: 4-phenyl-5,5,5-tris(phenylsulfanyl)pentan-2-one.
Chemical Property Profile of 4-Phenyl-5,5,5-tris(phenylsulfanyl)pentan-2-one
Property Insights of 4-Phenyl-5,5,5-tris(phenylsulfanyl)pentan-2-one
The XLogP value of 8.3 indicates that 4-Phenyl-5,5,5-tris(phenylsulfanyl)pentan-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Phenyl-5,5,5-tris(phenylsulfanyl)pentan-2-one. Following Lipinski's Rule of Five, 4-Phenyl-5,5,5-tris(phenylsulfanyl)pentan-2-one has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-Phenyl-5,5,5-tris(phenylsulfanyl)pentan-2-one?
The CAS number of 4-Phenyl-5,5,5-tris(phenylsulfanyl)pentan-2-one is 56003-68-0.
What is the molecular formula of 4-Phenyl-5,5,5-tris(phenylsulfanyl)pentan-2-one?
The molecular formula of 4-Phenyl-5,5,5-tris(phenylsulfanyl)pentan-2-one is C29H26OS3.
What is the molecular weight of 4-Phenyl-5,5,5-tris(phenylsulfanyl)pentan-2-one?
The molecular weight of 4-Phenyl-5,5,5-tris(phenylsulfanyl)pentan-2-one is 486.11 g/mol.
Where can I buy 4-Phenyl-5,5,5-tris(phenylsulfanyl)pentan-2-one?
You can request a quote for 4-Phenyl-5,5,5-tris(phenylsulfanyl)pentan-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Phenyl-5,5,5-tris(phenylsulfanyl)pentan-2-one?
Yes, KEHONG BIO provides custom synthesis services for 4-Phenyl-5,5,5-tris(phenylsulfanyl)pentan-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.