5-nitro-4-N-(oxolan-2-ylmethyl)-2-N-phenethylpyrimidine-2,4,6-triamine
TL;DR: 5-nitro-4-N-(oxolan-2-ylmethyl)-2-N-phenethylpyrimidine-2,4,6-triamine (CAS 578697-40-2) is a chemical compound with molecular formula C17H22N6O3 and molecular weight 358.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-nitro-4-N-(oxolan-2-ylmethyl)-2-N-(2-phenylethyl)pyrimidine-2,4,6-triamine
Also Known As: 5-nitro-4-N-(oxolan-2-ylmethyl)-2-N-phenethylpyrimidine-2,4,6-triamine, 5-nitro-N4-(oxolan-2-ylmethyl)-N2-phenethyl-pyrimidine-2,4,6-triamine, {6-amino-5-nitro-2-[(2-phenylethyl)amino]pyrimidin-4-yl}(oxolan-2-ylmethyl)ami ne, 5-nitro-N~2~-(2-phenylethyl)-N~4~-(tetrahydrofuran-2-ylmethyl)pyrimidine-2,4,6-triamine, 5-nitro-N2-phenethyl-N4-((tetrahydrofuran-2-yl)methyl)pyrimidine-2,4,6-triamine
| Molecular Formula | C17H22N6O3 |
|---|---|
| Molecular Weight | 358.18 g/mol |
| LogP | 2.2125 |
| Topological Polar Surface Area | 128.23 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 358.17532 |
| Heavy Atoms | 26 |
| Complexity | 749.66345 |
Chemical Identifiers
| CAS Number | 578697-40-2 |
|---|---|
| SMILES | C1CC(OC1)CNC2=NC(=NC(=C2[N+](=O)[O-])N)NCCC3=CC=CC=C3 |
Product Overview
5-nitro-4-N-(oxolan-2-ylmethyl)-2-N-phenethylpyrimidine-2,4,6-triamine (CAS 578697-40-2), with molecular formula C17H22N6O3 and molecular weight 358.18 g/mol. IUPAC: 5-nitro-4-N-(oxolan-2-ylmethyl)-2-N-(2-phenylethyl)pyrimidine-2,4,6-triamine.
Chemical Property Profile of 5-nitro-4-N-(oxolan-2-ylmethyl)-2-N-phenethylpyrimidine-2,4,6-triamine
Property Insights of 5-nitro-4-N-(oxolan-2-ylmethyl)-2-N-phenethylpyrimidine-2,4,6-triamine
The XLogP value of 2.2125 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-nitro-4-N-(oxolan-2-ylmethyl)-2-N-phenethylpyrimidine-2,4,6-triamine. The TPSA of 128.23 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-nitro-4-N-(oxolan-2-ylmethyl)-2-N-phenethylpyrimidine-2,4,6-triamine. Following Lipinski's Rule of Five, 5-nitro-4-N-(oxolan-2-ylmethyl)-2-N-phenethylpyrimidine-2,4,6-triamine 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 5-nitro-4-N-(oxolan-2-ylmethyl)-2-N-phenethylpyrimidine-2,4,6-triamine?
The CAS number of 5-nitro-4-N-(oxolan-2-ylmethyl)-2-N-phenethylpyrimidine-2,4,6-triamine is 578697-40-2.
What is the molecular formula of 5-nitro-4-N-(oxolan-2-ylmethyl)-2-N-phenethylpyrimidine-2,4,6-triamine?
The molecular formula of 5-nitro-4-N-(oxolan-2-ylmethyl)-2-N-phenethylpyrimidine-2,4,6-triamine is C17H22N6O3.
What is the molecular weight of 5-nitro-4-N-(oxolan-2-ylmethyl)-2-N-phenethylpyrimidine-2,4,6-triamine?
The molecular weight of 5-nitro-4-N-(oxolan-2-ylmethyl)-2-N-phenethylpyrimidine-2,4,6-triamine is 358.18 g/mol.
Where can I buy 5-nitro-4-N-(oxolan-2-ylmethyl)-2-N-phenethylpyrimidine-2,4,6-triamine?
You can request a quote for 5-nitro-4-N-(oxolan-2-ylmethyl)-2-N-phenethylpyrimidine-2,4,6-triamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-nitro-4-N-(oxolan-2-ylmethyl)-2-N-phenethylpyrimidine-2,4,6-triamine?
Yes, KEHONG BIO provides custom synthesis services for 5-nitro-4-N-(oxolan-2-ylmethyl)-2-N-phenethylpyrimidine-2,4,6-triamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.