N-(4-acetylphenyl)-5-bromonicotinamide
TL;DR: N-(4-acetylphenyl)-5-bromonicotinamide (CAS 313561-77-2) is a chemical compound with molecular formula C14H11BrN2O2 and molecular weight 318.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-acetylphenyl)-5-bromopyridine-3-carboxamide
Also Known As: N-(4-acetylphenyl)-5-bromonicotinamide, N-(4-acetylphenyl)-5-bromopyridine-3-carboxamide, AN-652/11705129
| Molecular Formula | C14H11BrN2O2 |
|---|---|
| Molecular Weight | 318.00 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 59.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 318.0004 |
| Heavy Atoms | 19 |
| Complexity | 340.0 |
Chemical Identifiers
| CAS Number | 313561-77-2 |
|---|---|
| SMILES | CC(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=CN=C2)Br |
| InChIKey | SEUNWJFDCPQTRW-UHFFFAOYSA-N |
Product Overview
N-(4-acetylphenyl)-5-bromonicotinamide (CAS 313561-77-2), with molecular formula C14H11BrN2O2 and molecular weight 318.00 g/mol. IUPAC: N-(4-acetylphenyl)-5-bromopyridine-3-carboxamide.
Chemical Property Profile of N-(4-acetylphenyl)-5-bromonicotinamide
Property Insights of N-(4-acetylphenyl)-5-bromonicotinamide
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-acetylphenyl)-5-bromonicotinamide. With a topological polar surface area (TPSA) of 59.1 Ų, N-(4-acetylphenyl)-5-bromonicotinamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(4-acetylphenyl)-5-bromonicotinamide has 1 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 N-(4-acetylphenyl)-5-bromonicotinamide?
The CAS number of N-(4-acetylphenyl)-5-bromonicotinamide is 313561-77-2.
What is the molecular formula of N-(4-acetylphenyl)-5-bromonicotinamide?
The molecular formula of N-(4-acetylphenyl)-5-bromonicotinamide is C14H11BrN2O2.
What is the molecular weight of N-(4-acetylphenyl)-5-bromonicotinamide?
The molecular weight of N-(4-acetylphenyl)-5-bromonicotinamide is 318.00 g/mol.
Where can I buy N-(4-acetylphenyl)-5-bromonicotinamide?
You can request a quote for N-(4-acetylphenyl)-5-bromonicotinamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-acetylphenyl)-5-bromonicotinamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-acetylphenyl)-5-bromonicotinamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.