5-bromo-N-(2-methoxy-5-nitrophenyl)nicotinamide
TL;DR: 5-bromo-N-(2-methoxy-5-nitrophenyl)nicotinamide (CAS 449168-06-3) is a chemical compound with molecular formula C13H10BrN3O4 and molecular weight 350.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-bromo-N-(2-methoxy-5-nitrophenyl)pyridine-3-carboxamide
Also Known As: 5-bromo-N-(2-methoxy-5-nitrophenyl)nicotinamide, 5-bromo-N-{5-nitro-2-methoxyphenyl}nicotinamide, AS-871/41252001, 5-bromo-N-(2-methoxy-5-nitrophenyl)pyridine-3-carboxamide, (5-bromo(3-pyridyl))-N-(2-methoxy-5-nitrophenyl)carboxamide
| Molecular Formula | C13H10BrN3O4 |
|---|---|
| Molecular Weight | 350.99 g/mol |
| LogP | 3.0132 |
| Topological Polar Surface Area | 94.36 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 350.98547 |
| Heavy Atoms | 21 |
| Complexity | 705.5658 |
Chemical Identifiers
| CAS Number | 449168-06-3 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C2=CC(=CN=C2)Br |
Product Overview
5-bromo-N-(2-methoxy-5-nitrophenyl)nicotinamide (CAS 449168-06-3), with molecular formula C13H10BrN3O4 and molecular weight 350.99 g/mol. IUPAC: 5-bromo-N-(2-methoxy-5-nitrophenyl)pyridine-3-carboxamide.
Chemical Property Profile of 5-bromo-N-(2-methoxy-5-nitrophenyl)nicotinamide
Property Insights of 5-bromo-N-(2-methoxy-5-nitrophenyl)nicotinamide
The XLogP value of 3.0132 indicates that 5-bromo-N-(2-methoxy-5-nitrophenyl)nicotinamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.36 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-bromo-N-(2-methoxy-5-nitrophenyl)nicotinamide. Following Lipinski's Rule of Five, 5-bromo-N-(2-methoxy-5-nitrophenyl)nicotinamide has 1 hydrogen bond donor(s) and 5 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 5-bromo-N-(2-methoxy-5-nitrophenyl)nicotinamide?
The CAS number of 5-bromo-N-(2-methoxy-5-nitrophenyl)nicotinamide is 449168-06-3.
What is the molecular formula of 5-bromo-N-(2-methoxy-5-nitrophenyl)nicotinamide?
The molecular formula of 5-bromo-N-(2-methoxy-5-nitrophenyl)nicotinamide is C13H10BrN3O4.
What is the molecular weight of 5-bromo-N-(2-methoxy-5-nitrophenyl)nicotinamide?
The molecular weight of 5-bromo-N-(2-methoxy-5-nitrophenyl)nicotinamide is 350.99 g/mol.
Where can I buy 5-bromo-N-(2-methoxy-5-nitrophenyl)nicotinamide?
You can request a quote for 5-bromo-N-(2-methoxy-5-nitrophenyl)nicotinamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-bromo-N-(2-methoxy-5-nitrophenyl)nicotinamide?
Yes, KEHONG BIO provides custom synthesis services for 5-bromo-N-(2-methoxy-5-nitrophenyl)nicotinamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.