![1-[4-Methyl-2-(2-methylphenyl)-1,3-thiazol-5-yl]ethan-1-one structure](/static/products/540/54001-05-7.png)
1-[4-Methyl-2-(2-methylphenyl)-1,3-thiazol-5-yl]ethan-1-one
TL;DR: 1-[4-Methyl-2-(2-methylphenyl)-1,3-thiazol-5-yl]ethan-1-one (CAS 54001-05-7) is a chemical compound with molecular formula C13H13NOS and molecular weight 231.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-methyl-2-(2-methylphenyl)-1,3-thiazol-5-yl]ethanone
Also Known As: 1-[4-methyl-2-(2-methylphenyl)-1,3-thiazol-5-yl]ethan-1-one, 1-[4-METHYL-2-(2-METHYLPHENYL)-1,3-THIAZOL-5-YL]ETHANONE
| Molecular Formula | C13H13NOS |
|---|---|
| Molecular Weight | 231.07 g/mol |
| LogP | 3.62954 |
| Topological Polar Surface Area | 29.96 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 231.0718 |
| Heavy Atoms | 16 |
| Complexity | 542.61566 |
Chemical Identifiers
| CAS Number | 54001-05-7 |
|---|---|
| SMILES | CC1=CC=CC=C1C2=NC(=C(S2)C(=O)C)C |
Product Overview
1-[4-Methyl-2-(2-methylphenyl)-1,3-thiazol-5-yl]ethan-1-one (CAS 54001-05-7), with molecular formula C13H13NOS and molecular weight 231.07 g/mol. IUPAC: 1-[4-methyl-2-(2-methylphenyl)-1,3-thiazol-5-yl]ethanone.
Chemical Property Profile of 1-[4-Methyl-2-(2-methylphenyl)-1,3-thiazol-5-yl]ethan-1-one
Property Insights of 1-[4-Methyl-2-(2-methylphenyl)-1,3-thiazol-5-yl]ethan-1-one
The XLogP value of 3.62954 indicates that 1-[4-Methyl-2-(2-methylphenyl)-1,3-thiazol-5-yl]ethan-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.96 Ų, 1-[4-Methyl-2-(2-methylphenyl)-1,3-thiazol-5-yl]ethan-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[4-Methyl-2-(2-methylphenyl)-1,3-thiazol-5-yl]ethan-1-one 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-Methyl-2-(2-methylphenyl)-1,3-thiazol-5-yl]ethan-1-one?
The CAS number of 1-[4-Methyl-2-(2-methylphenyl)-1,3-thiazol-5-yl]ethan-1-one is 54001-05-7.
What is the molecular formula of 1-[4-Methyl-2-(2-methylphenyl)-1,3-thiazol-5-yl]ethan-1-one?
The molecular formula of 1-[4-Methyl-2-(2-methylphenyl)-1,3-thiazol-5-yl]ethan-1-one is C13H13NOS.
What is the molecular weight of 1-[4-Methyl-2-(2-methylphenyl)-1,3-thiazol-5-yl]ethan-1-one?
The molecular weight of 1-[4-Methyl-2-(2-methylphenyl)-1,3-thiazol-5-yl]ethan-1-one is 231.07 g/mol.
Where can I buy 1-[4-Methyl-2-(2-methylphenyl)-1,3-thiazol-5-yl]ethan-1-one?
You can request a quote for 1-[4-Methyl-2-(2-methylphenyl)-1,3-thiazol-5-yl]ethan-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-Methyl-2-(2-methylphenyl)-1,3-thiazol-5-yl]ethan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 1-[4-Methyl-2-(2-methylphenyl)-1,3-thiazol-5-yl]ethan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.