![{6-amino-5-nitro-2-[(oxolan-2-ylmethyl)amino]pyrimidin-4-yl}(4-ethoxyphenyl)am ine structure](/static/products/586/586986-44-9.png)
{6-amino-5-nitro-2-[(oxolan-2-ylmethyl)amino]pyrimidin-4-yl}(4-ethoxyphenyl)am ine
TL;DR: {6-amino-5-nitro-2-[(oxolan-2-ylmethyl)amino]pyrimidin-4-yl}(4-ethoxyphenyl)am ine (CAS 586986-44-9) is a chemical compound with molecular formula C17H22N6O4 and molecular weight 374.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-N-(4-ethoxyphenyl)-5-nitro-2-N-(oxolan-2-ylmethyl)pyrimidine-2,4,6-triamine
Also Known As: {6-amino-5-nitro-2-[(oxolan-2-ylmethyl)amino]pyrimidin-4-yl}(4-ethoxyphenyl)am ine, 4-N-(4-ethoxyphenyl)-5-nitro-2-N-(oxolan-2-ylmethyl)pyrimidine-2,4,6-triamine, N~4~-(4-ethoxyphenyl)-5-nitro-N~2~-(tetrahydrofuran-2-ylmethyl)pyrimidine-2,4,6-triamine, N4-(4-ethoxyphenyl)-5-nitro-N2-((tetrahydrofuran-2-yl)methyl)pyrimidine-2,4,6-triamine
| Molecular Formula | C17H22N6O4 |
|---|---|
| Molecular Weight | 374.17 g/mol |
| LogP | 2.7002 |
| Topological Polar Surface Area | 137.46 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 8 |
| Exact Mass | 374.17026 |
| Heavy Atoms | 27 |
| Complexity | 792.7558 |
Chemical Identifiers
| CAS Number | 586986-44-9 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)NC2=NC(=NC(=C2[N+](=O)[O-])N)NCC3CCCO3 |
Product Overview
{6-amino-5-nitro-2-[(oxolan-2-ylmethyl)amino]pyrimidin-4-yl}(4-ethoxyphenyl)am ine (CAS 586986-44-9), with molecular formula C17H22N6O4 and molecular weight 374.17 g/mol. IUPAC: 4-N-(4-ethoxyphenyl)-5-nitro-2-N-(oxolan-2-ylmethyl)pyrimidine-2,4,6-triamine.
Chemical Property Profile of {6-amino-5-nitro-2-[(oxolan-2-ylmethyl)amino]pyrimidin-4-yl}(4-ethoxyphenyl)am ine
Property Insights of {6-amino-5-nitro-2-[(oxolan-2-ylmethyl)amino]pyrimidin-4-yl}(4-ethoxyphenyl)am ine
The XLogP value of 2.7002 suggests moderate lipophilicity, balancing water solubility and membrane permeability for {6-amino-5-nitro-2-[(oxolan-2-ylmethyl)amino]pyrimidin-4-yl}(4-ethoxyphenyl)am ine. The TPSA of 137.46 Ų falls within the moderate polarity range, balancing permeability and solubility for {6-amino-5-nitro-2-[(oxolan-2-ylmethyl)amino]pyrimidin-4-yl}(4-ethoxyphenyl)am ine. Following Lipinski's Rule of Five, {6-amino-5-nitro-2-[(oxolan-2-ylmethyl)amino]pyrimidin-4-yl}(4-ethoxyphenyl)am ine has 3 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-amino-5-nitro-2-[(oxolan-2-ylmethyl)amino]pyrimidin-4-yl}(4-ethoxyphenyl)am ine?
The CAS number of {6-amino-5-nitro-2-[(oxolan-2-ylmethyl)amino]pyrimidin-4-yl}(4-ethoxyphenyl)am ine is 586986-44-9.
What is the molecular formula of {6-amino-5-nitro-2-[(oxolan-2-ylmethyl)amino]pyrimidin-4-yl}(4-ethoxyphenyl)am ine?
The molecular formula of {6-amino-5-nitro-2-[(oxolan-2-ylmethyl)amino]pyrimidin-4-yl}(4-ethoxyphenyl)am ine is C17H22N6O4.
What is the molecular weight of {6-amino-5-nitro-2-[(oxolan-2-ylmethyl)amino]pyrimidin-4-yl}(4-ethoxyphenyl)am ine?
The molecular weight of {6-amino-5-nitro-2-[(oxolan-2-ylmethyl)amino]pyrimidin-4-yl}(4-ethoxyphenyl)am ine is 374.17 g/mol.
Where can I buy {6-amino-5-nitro-2-[(oxolan-2-ylmethyl)amino]pyrimidin-4-yl}(4-ethoxyphenyl)am ine?
You can request a quote for {6-amino-5-nitro-2-[(oxolan-2-ylmethyl)amino]pyrimidin-4-yl}(4-ethoxyphenyl)am ine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for {6-amino-5-nitro-2-[(oxolan-2-ylmethyl)amino]pyrimidin-4-yl}(4-ethoxyphenyl)am ine?
Yes, KEHONG BIO provides custom synthesis services for {6-amino-5-nitro-2-[(oxolan-2-ylmethyl)amino]pyrimidin-4-yl}(4-ethoxyphenyl)am ine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.