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1-[(4-Chlorophenyl)sulfanyl]-3-(phenylsulfanyl)acetone
TL;DR: 1-[(4-Chlorophenyl)sulfanyl]-3-(phenylsulfanyl)acetone (CAS 338409-49-7) is a chemical compound with molecular formula C15H13ClOS2 and molecular weight 308.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-chlorophenyl)sulfanyl-3-phenylsulfanylpropan-2-one
Also Known As: 3H-423S, 1-[(4-chlorophenyl)sulfanyl]-3-(phenylsulfanyl)acetone, 1-(4-chlorophenyl)sulfanyl-3-phenylsulfanylpropan-2-one, 1-[(4-chlorophenyl)sulfanyl]-3-(phenylsulfanyl)propan-2-one
| Molecular Formula | C15H13ClOS2 |
|---|---|
| Molecular Weight | 308.01 g/mol |
| LogP | 4.7935 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 308.00964 |
| Heavy Atoms | 19 |
| Complexity | 525.6017 |
Chemical Identifiers
| CAS Number | 338409-49-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)SCC(=O)CSC2=CC=C(C=C2)Cl |
Product Overview
1-[(4-Chlorophenyl)sulfanyl]-3-(phenylsulfanyl)acetone (CAS 338409-49-7), with molecular formula C15H13ClOS2 and molecular weight 308.01 g/mol. IUPAC: 1-(4-chlorophenyl)sulfanyl-3-phenylsulfanylpropan-2-one.
Chemical Property Profile of 1-[(4-Chlorophenyl)sulfanyl]-3-(phenylsulfanyl)acetone
Property Insights of 1-[(4-Chlorophenyl)sulfanyl]-3-(phenylsulfanyl)acetone
The XLogP value of 4.7935 indicates that 1-[(4-Chlorophenyl)sulfanyl]-3-(phenylsulfanyl)acetone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.07 Ų, 1-[(4-Chlorophenyl)sulfanyl]-3-(phenylsulfanyl)acetone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[(4-Chlorophenyl)sulfanyl]-3-(phenylsulfanyl)acetone 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 1-[(4-Chlorophenyl)sulfanyl]-3-(phenylsulfanyl)acetone?
The CAS number of 1-[(4-Chlorophenyl)sulfanyl]-3-(phenylsulfanyl)acetone is 338409-49-7.
What is the molecular formula of 1-[(4-Chlorophenyl)sulfanyl]-3-(phenylsulfanyl)acetone?
The molecular formula of 1-[(4-Chlorophenyl)sulfanyl]-3-(phenylsulfanyl)acetone is C15H13ClOS2.
What is the molecular weight of 1-[(4-Chlorophenyl)sulfanyl]-3-(phenylsulfanyl)acetone?
The molecular weight of 1-[(4-Chlorophenyl)sulfanyl]-3-(phenylsulfanyl)acetone is 308.01 g/mol.
Where can I buy 1-[(4-Chlorophenyl)sulfanyl]-3-(phenylsulfanyl)acetone?
You can request a quote for 1-[(4-Chlorophenyl)sulfanyl]-3-(phenylsulfanyl)acetone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[(4-Chlorophenyl)sulfanyl]-3-(phenylsulfanyl)acetone?
Yes, KEHONG BIO provides custom synthesis services for 1-[(4-Chlorophenyl)sulfanyl]-3-(phenylsulfanyl)acetone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.