1-(4-Methylphenyl)-3-(2-thienyl)-2-propen-1-one
TL;DR: 1-(4-Methylphenyl)-3-(2-thienyl)-2-propen-1-one (CAS 6028-89-3) is a chemical compound with molecular formula C14H12OS and molecular weight 228.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-methylphenyl)-3-thiophen-2-ylprop-2-en-1-one
Also Known As: 4'-Methyl-3-(2-thienyl)acrylophenone, 1-(4-methylphenyl)-3-(2-thienyl)prop-2-en-1-one, 3-(Thiophen-2-yl)-1-(p-tolyl)prop-2-en-1-one, 1-(4-Methylphenyl)-3-(2-thienyl)-2-propen-1-one, 1-(p-tolyl)-3-(2-thienyl)prop-2-en-1-one
| Molecular Formula | C14H12OS |
|---|---|
| Molecular Weight | 228.06 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 45.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 228.06088 |
| Heavy Atoms | 16 |
| Complexity | 264.0 |
Chemical Identifiers
| CAS Number | 6028-89-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)C=CC2=CC=CS2 |
| InChIKey | OUDDTWPBSXBJOY-UHFFFAOYSA-N |
Product Overview
1-(4-Methylphenyl)-3-(2-thienyl)-2-propen-1-one (CAS 6028-89-3), with molecular formula C14H12OS and molecular weight 228.06 g/mol. IUPAC: 1-(4-methylphenyl)-3-thiophen-2-ylprop-2-en-1-one.
Chemical Property Profile of 1-(4-Methylphenyl)-3-(2-thienyl)-2-propen-1-one
Property Insights of 1-(4-Methylphenyl)-3-(2-thienyl)-2-propen-1-one
The XLogP value of 3.8 indicates that 1-(4-Methylphenyl)-3-(2-thienyl)-2-propen-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.3 Ų, 1-(4-Methylphenyl)-3-(2-thienyl)-2-propen-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Methylphenyl)-3-(2-thienyl)-2-propen-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 1-(4-Methylphenyl)-3-(2-thienyl)-2-propen-1-one?
The CAS number of 1-(4-Methylphenyl)-3-(2-thienyl)-2-propen-1-one is 6028-89-3.
What is the molecular formula of 1-(4-Methylphenyl)-3-(2-thienyl)-2-propen-1-one?
The molecular formula of 1-(4-Methylphenyl)-3-(2-thienyl)-2-propen-1-one is C14H12OS.
What is the molecular weight of 1-(4-Methylphenyl)-3-(2-thienyl)-2-propen-1-one?
The molecular weight of 1-(4-Methylphenyl)-3-(2-thienyl)-2-propen-1-one is 228.06 g/mol.
Where can I buy 1-(4-Methylphenyl)-3-(2-thienyl)-2-propen-1-one?
You can request a quote for 1-(4-Methylphenyl)-3-(2-thienyl)-2-propen-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Methylphenyl)-3-(2-thienyl)-2-propen-1-one?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Methylphenyl)-3-(2-thienyl)-2-propen-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.