2-((6-Amino-2-(azepan-1-yl)-5-nitropyrimidin-4-yl)amino)ethanol
TL;DR: 2-((6-Amino-2-(azepan-1-yl)-5-nitropyrimidin-4-yl)amino)ethanol (CAS 674297-38-2) is a chemical compound with molecular formula C12H20N6O3 and molecular weight 296.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[6-amino-2-(azepan-1-yl)-5-nitropyrimidin-4-yl]amino]ethanol
Also Known As: 2-((6-amino-2-(azepan-1-yl)-5-nitropyrimidin-4-yl)amino)ethanol, 2-[[6-amino-2-(azepan-1-yl)-5-nitro-pyrimidin-4-yl]amino]ethanol, 2-[[6-amino-2-(azepan-1-yl)-5-nitropyrimidin-4-yl]amino]ethanol, 2-{[6-amino-2-(azepan-1-yl)-5-nitropyrimidin-4-yl]amino}ethanol, 2-[(6-amino-2-azaperhydroepinyl-5-nitropyrimidin-4-yl)amino]ethan-1-ol
| Molecular Formula | C12H20N6O3 |
|---|---|
| Molecular Weight | 296.16 g/mol |
| LogP | 0.7516 |
| Topological Polar Surface Area | 130.44 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 296.1597 |
| Heavy Atoms | 21 |
| Complexity | 502.0113 |
Chemical Identifiers
| CAS Number | 674297-38-2 |
|---|---|
| SMILES | C1CCCN(CC1)C2=NC(=C(C(=N2)NCCO)[N+](=O)[O-])N |
Product Overview
2-((6-Amino-2-(azepan-1-yl)-5-nitropyrimidin-4-yl)amino)ethanol (CAS 674297-38-2), with molecular formula C12H20N6O3 and molecular weight 296.16 g/mol. IUPAC: 2-[[6-amino-2-(azepan-1-yl)-5-nitropyrimidin-4-yl]amino]ethanol.
Chemical Property Profile of 2-((6-Amino-2-(azepan-1-yl)-5-nitropyrimidin-4-yl)amino)ethanol
Property Insights of 2-((6-Amino-2-(azepan-1-yl)-5-nitropyrimidin-4-yl)amino)ethanol
The XLogP value of 0.7516 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-((6-Amino-2-(azepan-1-yl)-5-nitropyrimidin-4-yl)amino)ethanol. The TPSA of 130.44 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-((6-Amino-2-(azepan-1-yl)-5-nitropyrimidin-4-yl)amino)ethanol. Following Lipinski's Rule of Five, 2-((6-Amino-2-(azepan-1-yl)-5-nitropyrimidin-4-yl)amino)ethanol has 3 hydrogen bond donor(s) and 8 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-((6-Amino-2-(azepan-1-yl)-5-nitropyrimidin-4-yl)amino)ethanol?
The CAS number of 2-((6-Amino-2-(azepan-1-yl)-5-nitropyrimidin-4-yl)amino)ethanol is 674297-38-2.
What is the molecular formula of 2-((6-Amino-2-(azepan-1-yl)-5-nitropyrimidin-4-yl)amino)ethanol?
The molecular formula of 2-((6-Amino-2-(azepan-1-yl)-5-nitropyrimidin-4-yl)amino)ethanol is C12H20N6O3.
What is the molecular weight of 2-((6-Amino-2-(azepan-1-yl)-5-nitropyrimidin-4-yl)amino)ethanol?
The molecular weight of 2-((6-Amino-2-(azepan-1-yl)-5-nitropyrimidin-4-yl)amino)ethanol is 296.16 g/mol.
Where can I buy 2-((6-Amino-2-(azepan-1-yl)-5-nitropyrimidin-4-yl)amino)ethanol?
You can request a quote for 2-((6-Amino-2-(azepan-1-yl)-5-nitropyrimidin-4-yl)amino)ethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((6-Amino-2-(azepan-1-yl)-5-nitropyrimidin-4-yl)amino)ethanol?
Yes, KEHONG BIO provides custom synthesis services for 2-((6-Amino-2-(azepan-1-yl)-5-nitropyrimidin-4-yl)amino)ethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.