(E)-3-(4-chlorophenyl)-1-(4-methylsulfanylphenyl)prop-2-en-1-one
TL;DR: (E)-3-(4-chlorophenyl)-1-(4-methylsulfanylphenyl)prop-2-en-1-one (CAS 126443-17-2) is a chemical compound with molecular formula C16H13ClOS and molecular weight 288.03757 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-3-(4-chlorophenyl)-1-(4-methylsulfanylphenyl)prop-2-en-1-one
Also Known As: Chalcone, SGTSYISCBPSFMQ-NYYWCZLTSA-, 4/'-(Methylthio)-4-chlorochalcone, 4 -(Methylthio)-4-chlorochalcone, (E)-4-Chloro-4 -methylthiochalcone
Technical Specifications
| Molecular Formula | C16H13ClOS |
| Molecular Weight | 288.03757 g/mol |
| XLogP | 4.2 |
| Topological Polar Surface Area (TPSA) | 42.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 288.03757 Da |
| Heavy Atoms | 19 |
| Complexity | 313.0 |
| SMILES | CSC1=CC=C(C=C1)C(=O)/C=C/C2=CC=C(C=C2)Cl |
| InChIKey | SGTSYISCBPSFMQ-NYYWCZLTSA-N |
Chemical Property Profile of (E)-3-(4-chlorophenyl)-1-(4-methylsulfanylphenyl)prop-2-en-1-one
Property Insights of (E)-3-(4-chlorophenyl)-1-(4-methylsulfanylphenyl)prop-2-en-1-one
The XLogP value of 4.2 indicates that (E)-3-(4-chlorophenyl)-1-(4-methylsulfanylphenyl)prop-2-en-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.4 Ų, (E)-3-(4-chlorophenyl)-1-(4-methylsulfanylphenyl)prop-2-en-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-3-(4-chlorophenyl)-1-(4-methylsulfanylphenyl)prop-2-en-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
What is the CAS number of (E)-3-(4-chlorophenyl)-1-(4-methylsulfanylphenyl)prop-2-en-1-one?
The CAS number of (E)-3-(4-chlorophenyl)-1-(4-methylsulfanylphenyl)prop-2-en-1-one is 126443-17-2.
What is the molecular formula of (E)-3-(4-chlorophenyl)-1-(4-methylsulfanylphenyl)prop-2-en-1-one?
The molecular formula of (E)-3-(4-chlorophenyl)-1-(4-methylsulfanylphenyl)prop-2-en-1-one is C16H13ClOS.
What is the molecular weight of (E)-3-(4-chlorophenyl)-1-(4-methylsulfanylphenyl)prop-2-en-1-one?
The molecular weight of (E)-3-(4-chlorophenyl)-1-(4-methylsulfanylphenyl)prop-2-en-1-one is 288.03757 g/mol.
Where can I buy (E)-3-(4-chlorophenyl)-1-(4-methylsulfanylphenyl)prop-2-en-1-one?
You can request a quote for (E)-3-(4-chlorophenyl)-1-(4-methylsulfanylphenyl)prop-2-en-1-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (E)-3-(4-chlorophenyl)-1-(4-methylsulfanylphenyl)prop-2-en-1-one?
Yes, CoreyChem provides custom synthesis services for (E)-3-(4-chlorophenyl)-1-(4-methylsulfanylphenyl)prop-2-en-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.