![1-[2-(4-Bromoanilino)-4-methyl-1,3-thiazol-5-yl]ethanone structure](/static/products/1128/112833-16-6.webp)
1-[2-(4-Bromoanilino)-4-methyl-1,3-thiazol-5-yl]ethanone
TL;DR: 1-[2-(4-Bromoanilino)-4-methyl-1,3-thiazol-5-yl]ethanone (CAS 112833-16-6) is a chemical compound with molecular formula C12H11BrN2OS and molecular weight 309.97754 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[2-(4-bromoanilino)-4-methyl-1,3-thiazol-5-yl]ethanone
Also Known As: 1-[2-(4-bromoanilino)-4-methyl-1,3-thiazol-5-yl]ethanone, BAS 00393393, AQ-150/10164038, 1-(2-((4-bromophenyl)amino)-4-methylthiazol-5-yl)ethanone, 1-[2-(4-Bromo-phenylamino)-4-methyl-thiazol-5-yl]-ethanone
Technical Specifications
| Molecular Formula | C12H11BrN2OS |
| Molecular Weight | 309.97754 g/mol |
| XLogP | 3.9 |
| Topological Polar Surface Area (TPSA) | 70.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 309.97754 Da |
| Heavy Atoms | 17 |
| Complexity | 282.0 |
| SMILES | CC1=C(SC(=N1)NC2=CC=C(C=C2)Br)C(=O)C |
| InChIKey | OPNHBAJPHILCSX-UHFFFAOYSA-N |
Chemical Property Profile of 1-[2-(4-Bromoanilino)-4-methyl-1,3-thiazol-5-yl]ethanone
Property Insights of 1-[2-(4-Bromoanilino)-4-methyl-1,3-thiazol-5-yl]ethanone
The XLogP value of 3.9 indicates that 1-[2-(4-Bromoanilino)-4-methyl-1,3-thiazol-5-yl]ethanone 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-Bromoanilino)-4-methyl-1,3-thiazol-5-yl]ethanone. Following Lipinski's Rule of Five, 1-[2-(4-Bromoanilino)-4-methyl-1,3-thiazol-5-yl]ethanone 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
What is the CAS number of 1-[2-(4-Bromoanilino)-4-methyl-1,3-thiazol-5-yl]ethanone?
The CAS number of 1-[2-(4-Bromoanilino)-4-methyl-1,3-thiazol-5-yl]ethanone is 112833-16-6.
What is the molecular formula of 1-[2-(4-Bromoanilino)-4-methyl-1,3-thiazol-5-yl]ethanone?
The molecular formula of 1-[2-(4-Bromoanilino)-4-methyl-1,3-thiazol-5-yl]ethanone is C12H11BrN2OS.
What is the molecular weight of 1-[2-(4-Bromoanilino)-4-methyl-1,3-thiazol-5-yl]ethanone?
The molecular weight of 1-[2-(4-Bromoanilino)-4-methyl-1,3-thiazol-5-yl]ethanone is 309.97754 g/mol.
Where can I buy 1-[2-(4-Bromoanilino)-4-methyl-1,3-thiazol-5-yl]ethanone?
You can request a quote for 1-[2-(4-Bromoanilino)-4-methyl-1,3-thiazol-5-yl]ethanone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-[2-(4-Bromoanilino)-4-methyl-1,3-thiazol-5-yl]ethanone?
Yes, CoreyChem provides custom synthesis services for 1-[2-(4-Bromoanilino)-4-methyl-1,3-thiazol-5-yl]ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.