3-bromo-N-(2,4,6-trimethylphenyl)propanamide
TL;DR: 3-bromo-N-(2,4,6-trimethylphenyl)propanamide (CAS 53985-05-0) is a chemical compound with molecular formula C12H16BrNO and molecular weight 269.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-bromo-N-(2,4,6-trimethylphenyl)propanamide
Also Known As: 3-bromo-N-mesitylpropanamide, 3-bromo-N-(2,4,6-trimethylphenyl)propanamide, N-(2,4,6-Trimethylphenyl)-3-bromopropanamide
| Molecular Formula | C12H16BrNO |
|---|---|
| Molecular Weight | 269.04 g/mol |
| LogP | 3.33536 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 269.04153 |
| Heavy Atoms | 15 |
| Complexity | 350.88004 |
Chemical Identifiers
| CAS Number | 53985-05-0 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1)C)NC(=O)CCBr)C |
Product Overview
3-bromo-N-(2,4,6-trimethylphenyl)propanamide (CAS 53985-05-0), with molecular formula C12H16BrNO and molecular weight 269.04 g/mol. IUPAC: 3-bromo-N-(2,4,6-trimethylphenyl)propanamide.
Chemical Property Profile of 3-bromo-N-(2,4,6-trimethylphenyl)propanamide
Property Insights of 3-bromo-N-(2,4,6-trimethylphenyl)propanamide
The XLogP value of 3.33536 indicates that 3-bromo-N-(2,4,6-trimethylphenyl)propanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, 3-bromo-N-(2,4,6-trimethylphenyl)propanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-bromo-N-(2,4,6-trimethylphenyl)propanamide has 1 hydrogen bond donor(s) and 1 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 3-bromo-N-(2,4,6-trimethylphenyl)propanamide?
The CAS number of 3-bromo-N-(2,4,6-trimethylphenyl)propanamide is 53985-05-0.
What is the molecular formula of 3-bromo-N-(2,4,6-trimethylphenyl)propanamide?
The molecular formula of 3-bromo-N-(2,4,6-trimethylphenyl)propanamide is C12H16BrNO.
What is the molecular weight of 3-bromo-N-(2,4,6-trimethylphenyl)propanamide?
The molecular weight of 3-bromo-N-(2,4,6-trimethylphenyl)propanamide is 269.04 g/mol.
Where can I buy 3-bromo-N-(2,4,6-trimethylphenyl)propanamide?
You can request a quote for 3-bromo-N-(2,4,6-trimethylphenyl)propanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-bromo-N-(2,4,6-trimethylphenyl)propanamide?
Yes, KEHONG BIO provides custom synthesis services for 3-bromo-N-(2,4,6-trimethylphenyl)propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.