![6-(azepan-1-yl)-N~2~-[3-(morpholin-4-yl)propyl]-5-nitropyrimidine-2,4-diamine structure](/static/products/714/714226-59-2.png)
6-(azepan-1-yl)-N~2~-[3-(morpholin-4-yl)propyl]-5-nitropyrimidine-2,4-diamine
TL;DR: 6-(azepan-1-yl)-N~2~-[3-(morpholin-4-yl)propyl]-5-nitropyrimidine-2,4-diamine (CAS 714226-59-2) is a chemical compound with molecular formula C17H29N7O3 and molecular weight 379.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(azepan-1-yl)-2-N-(3-morpholin-4-ylpropyl)-5-nitropyrimidine-2,4-diamine
Also Known As: 6-(azepan-1-yl)-N2-(3-morpholinopropyl)-5-nitropyrimidine-2,4-diamine, (4-amino-6-azaperhydroepinyl-5-nitropyrimidin-2-yl)(3-morpholin-4-ylpropyl)ami ne, 6-(azepan-1-yl)-2-N-(3-morpholin-4-ylpropyl)-5-nitropyrimidine-2,4-diamine, 6-(azepan-1-yl)-N-(3-morpholin-4-ylpropyl)-5-nitro-pyrimidine-2,4-diamine, 6-(azepan-1-yl)-N~2~-[3-(morpholin-4-yl)propyl]-5-nitropyrimidine-2,4-diamine
| Molecular Formula | C17H29N7O3 |
|---|---|
| Molecular Weight | 379.23 g/mol |
| LogP | 1.4816 |
| Topological Polar Surface Area | 122.68 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 7 |
| Exact Mass | 379.2332 |
| Heavy Atoms | 27 |
| Complexity | 629.1982 |
Chemical Identifiers
| CAS Number | 714226-59-2 |
|---|---|
| SMILES | C1CCCN(CC1)C2=NC(=NC(=C2[N+](=O)[O-])N)NCCCN3CCOCC3 |
Product Overview
6-(azepan-1-yl)-N~2~-[3-(morpholin-4-yl)propyl]-5-nitropyrimidine-2,4-diamine (CAS 714226-59-2), with molecular formula C17H29N7O3 and molecular weight 379.23 g/mol. IUPAC: 6-(azepan-1-yl)-2-N-(3-morpholin-4-ylpropyl)-5-nitropyrimidine-2,4-diamine.
Chemical Property Profile of 6-(azepan-1-yl)-N~2~-[3-(morpholin-4-yl)propyl]-5-nitropyrimidine-2,4-diamine
Property Insights of 6-(azepan-1-yl)-N~2~-[3-(morpholin-4-yl)propyl]-5-nitropyrimidine-2,4-diamine
The XLogP value of 1.4816 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-(azepan-1-yl)-N~2~-[3-(morpholin-4-yl)propyl]-5-nitropyrimidine-2,4-diamine. The TPSA of 122.68 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-(azepan-1-yl)-N~2~-[3-(morpholin-4-yl)propyl]-5-nitropyrimidine-2,4-diamine. Following Lipinski's Rule of Five, 6-(azepan-1-yl)-N~2~-[3-(morpholin-4-yl)propyl]-5-nitropyrimidine-2,4-diamine has 2 hydrogen bond donor(s) and 9 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 6-(azepan-1-yl)-N~2~-[3-(morpholin-4-yl)propyl]-5-nitropyrimidine-2,4-diamine?
The CAS number of 6-(azepan-1-yl)-N~2~-[3-(morpholin-4-yl)propyl]-5-nitropyrimidine-2,4-diamine is 714226-59-2.
What is the molecular formula of 6-(azepan-1-yl)-N~2~-[3-(morpholin-4-yl)propyl]-5-nitropyrimidine-2,4-diamine?
The molecular formula of 6-(azepan-1-yl)-N~2~-[3-(morpholin-4-yl)propyl]-5-nitropyrimidine-2,4-diamine is C17H29N7O3.
What is the molecular weight of 6-(azepan-1-yl)-N~2~-[3-(morpholin-4-yl)propyl]-5-nitropyrimidine-2,4-diamine?
The molecular weight of 6-(azepan-1-yl)-N~2~-[3-(morpholin-4-yl)propyl]-5-nitropyrimidine-2,4-diamine is 379.23 g/mol.
Where can I buy 6-(azepan-1-yl)-N~2~-[3-(morpholin-4-yl)propyl]-5-nitropyrimidine-2,4-diamine?
You can request a quote for 6-(azepan-1-yl)-N~2~-[3-(morpholin-4-yl)propyl]-5-nitropyrimidine-2,4-diamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-(azepan-1-yl)-N~2~-[3-(morpholin-4-yl)propyl]-5-nitropyrimidine-2,4-diamine?
Yes, KEHONG BIO provides custom synthesis services for 6-(azepan-1-yl)-N~2~-[3-(morpholin-4-yl)propyl]-5-nitropyrimidine-2,4-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.