2-Bromo-6-methyl-5-nitropyridine
TL;DR: 2-Bromo-6-methyl-5-nitropyridine (CAS 799771-97-4) is a chemical compound with molecular formula C24H24N6O2 and molecular weight 428.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-[2-(4-benzylpiperazin-1-yl)-9-methyl-4-oxopyrido[1,2-a]pyrimidin-3-yl]-2-cyanoprop-2-enamide
Also Known As: 2-Bromo-6-methyl-5-nitropyridine, (2E)-3-[2-(4-benzylpiperazin-1-yl)-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-2-cyanoprop-2-enamide, (E)-3-(2-(4-benzylpiperazin-1-yl)-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)-2-cyanoacrylamide, (E)-3-[2-(4-benzylpiperazin-1-yl)-9-methyl-4-oxopyrido[1,2-a]pyrimidin-3-yl]-2-cyanoprop-2-enamide
| Molecular Formula | C24H24N6O2 |
|---|---|
| Molecular Weight | 428.20 g/mol |
| LogP | 1.7174 |
| Topological Polar Surface Area | 107.73 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 428.19608 |
| Heavy Atoms | 32 |
| Complexity | 1281.5726 |
Chemical Identifiers
| CAS Number | 799771-97-4 |
|---|---|
| SMILES | CC1=CC=CN2C1=NC(=C(C2=O)/C=C(\C#N)/C(=O)N)N3CCN(CC3)CC4=CC=CC=C4 |
Product Overview
2-Bromo-6-methyl-5-nitropyridine (CAS 799771-97-4), with molecular formula C24H24N6O2 and molecular weight 428.20 g/mol. IUPAC: (E)-3-[2-(4-benzylpiperazin-1-yl)-9-methyl-4-oxopyrido[1,2-a]pyrimidin-3-yl]-2-cyanoprop-2-enamide.
Chemical Property Profile of 2-Bromo-6-methyl-5-nitropyridine
Property Insights of 2-Bromo-6-methyl-5-nitropyridine
The XLogP value of 1.7174 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Bromo-6-methyl-5-nitropyridine. The TPSA of 107.73 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Bromo-6-methyl-5-nitropyridine. Following Lipinski's Rule of Five, 2-Bromo-6-methyl-5-nitropyridine has 1 hydrogen bond donor(s) and 6 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 2-Bromo-6-methyl-5-nitropyridine?
The CAS number of 2-Bromo-6-methyl-5-nitropyridine is 799771-97-4.
What is the molecular formula of 2-Bromo-6-methyl-5-nitropyridine?
The molecular formula of 2-Bromo-6-methyl-5-nitropyridine is C24H24N6O2.
What is the molecular weight of 2-Bromo-6-methyl-5-nitropyridine?
The molecular weight of 2-Bromo-6-methyl-5-nitropyridine is 428.20 g/mol.
Where can I buy 2-Bromo-6-methyl-5-nitropyridine?
You can request a quote for 2-Bromo-6-methyl-5-nitropyridine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Bromo-6-methyl-5-nitropyridine?
Yes, KEHONG BIO provides custom synthesis services for 2-Bromo-6-methyl-5-nitropyridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.