![1-[2-(4-Chloroanilino)-4-methyl-1,3-thiazol-5-yl]ethan-1-one structure](/static/products/7104/71047-49-9.webp)
1-[2-(4-Chloroanilino)-4-methyl-1,3-thiazol-5-yl]ethan-1-one
TL;DR: 1-[2-(4-Chloroanilino)-4-methyl-1,3-thiazol-5-yl]ethan-1-one (CAS 71047-49-9) is a chemical compound with molecular formula C12H11ClN2OS and molecular weight 266.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-(4-chloroanilino)-4-methyl-1,3-thiazol-5-yl]ethanone
Also Known As: J2.990.674B, 1-[2-(4-chloroanilino)-4-methyl-1,3-thiazol-5-yl]ethanone, 5-acetyl-4-methyl-2-(p-chlorophenylamino)-thiazole, N-(4-Chlorophenyl)-4-methyl-5-acetylthiazole-2-amine, 1-[2-(4-Chloroanilino)-4-methyl-1,3-thiazol-5-yl]ethan-1-one
| Molecular Formula | C12H11ClN2OS |
|---|---|
| Molecular Weight | 266.03 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 70.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 266.02808 |
| Heavy Atoms | 17 |
| Complexity | 282.0 |
Chemical Identifiers
| CAS Number | 71047-49-9 |
|---|---|
| SMILES | CC1=C(SC(=N1)NC2=CC=C(C=C2)Cl)C(=O)C |
| InChIKey | XOZRUSFCUSTMCO-UHFFFAOYSA-N |
Product Overview
1-[2-(4-Chloroanilino)-4-methyl-1,3-thiazol-5-yl]ethan-1-one (CAS 71047-49-9), with molecular formula C12H11ClN2OS and molecular weight 266.03 g/mol. IUPAC: 1-[2-(4-chloroanilino)-4-methyl-1,3-thiazol-5-yl]ethanone.
Chemical Property Profile of 1-[2-(4-Chloroanilino)-4-methyl-1,3-thiazol-5-yl]ethan-1-one
Property Insights of 1-[2-(4-Chloroanilino)-4-methyl-1,3-thiazol-5-yl]ethan-1-one
The XLogP value of 3.9 indicates that 1-[2-(4-Chloroanilino)-4-methyl-1,3-thiazol-5-yl]ethan-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[2-(4-Chloroanilino)-4-methyl-1,3-thiazol-5-yl]ethan-1-one. Following Lipinski's Rule of Five, 1-[2-(4-Chloroanilino)-4-methyl-1,3-thiazol-5-yl]ethan-1-one has 1 hydrogen bond donor(s) and 4 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-[2-(4-Chloroanilino)-4-methyl-1,3-thiazol-5-yl]ethan-1-one?
The CAS number of 1-[2-(4-Chloroanilino)-4-methyl-1,3-thiazol-5-yl]ethan-1-one is 71047-49-9.
What is the molecular formula of 1-[2-(4-Chloroanilino)-4-methyl-1,3-thiazol-5-yl]ethan-1-one?
The molecular formula of 1-[2-(4-Chloroanilino)-4-methyl-1,3-thiazol-5-yl]ethan-1-one is C12H11ClN2OS.
What is the molecular weight of 1-[2-(4-Chloroanilino)-4-methyl-1,3-thiazol-5-yl]ethan-1-one?
The molecular weight of 1-[2-(4-Chloroanilino)-4-methyl-1,3-thiazol-5-yl]ethan-1-one is 266.03 g/mol.
Where can I buy 1-[2-(4-Chloroanilino)-4-methyl-1,3-thiazol-5-yl]ethan-1-one?
You can request a quote for 1-[2-(4-Chloroanilino)-4-methyl-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-[2-(4-Chloroanilino)-4-methyl-1,3-thiazol-5-yl]ethan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 1-[2-(4-Chloroanilino)-4-methyl-1,3-thiazol-5-yl]ethan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.