![{6-amino-2-[(3,4-dimethylphenyl)amino]-5-nitropyrimidin-4-yl}(oxolan-2-ylmethy l)amine structure](/static/products/586/586994-07-2.png)
{6-amino-2-[(3,4-dimethylphenyl)amino]-5-nitropyrimidin-4-yl}(oxolan-2-ylmethy l)amine
TL;DR: {6-amino-2-[(3,4-dimethylphenyl)amino]-5-nitropyrimidin-4-yl}(oxolan-2-ylmethy l)amine (CAS 586994-07-2) 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.
2-N-(3,4-dimethylphenyl)-5-nitro-4-N-(oxolan-2-ylmethyl)pyrimidine-2,4,6-triamine
Also Known As: {6-amino-2-[(3,4-dimethylphenyl)amino]-5-nitropyrimidin-4-yl}(oxolan-2-ylmethy l)amine, 2-N-(3,4-dimethylphenyl)-5-nitro-4-N-(oxolan-2-ylmethyl)pyrimidine-2,4,6-triamine, N2-(3,4-DIMETHYLPHENYL)-5-NITRO-N4-[(OXOLAN-2-YL)METHYL]PYRIMIDINE-2,4,6-TRIAMINE, N~2~-(3,4-dimethylphenyl)-5-nitro-N~4~-(tetrahydrofuran-2-ylmethyl)pyrimidine-2,4,6-triamine, N2-(3,4-dimethylphenyl)-5-nitro-N4-((tetrahydrofuran-2-yl)methyl)pyrimidine-2,4,6-triamine
| Molecular Formula | C17H22N6O3 |
|---|---|
| Molecular Weight | 358.18 g/mol |
| LogP | 2.91834 |
| Topological Polar Surface Area | 128.23 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 358.17532 |
| Heavy Atoms | 26 |
| Complexity | 820.3858 |
Chemical Identifiers
| CAS Number | 586994-07-2 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)NC2=NC(=C(C(=N2)NCC3CCCO3)[N+](=O)[O-])N)C |
Product Overview
{6-amino-2-[(3,4-dimethylphenyl)amino]-5-nitropyrimidin-4-yl}(oxolan-2-ylmethy l)amine (CAS 586994-07-2), with molecular formula C17H22N6O3 and molecular weight 358.18 g/mol. IUPAC: 2-N-(3,4-dimethylphenyl)-5-nitro-4-N-(oxolan-2-ylmethyl)pyrimidine-2,4,6-triamine.
Chemical Property Profile of {6-amino-2-[(3,4-dimethylphenyl)amino]-5-nitropyrimidin-4-yl}(oxolan-2-ylmethy l)amine
Property Insights of {6-amino-2-[(3,4-dimethylphenyl)amino]-5-nitropyrimidin-4-yl}(oxolan-2-ylmethy l)amine
The XLogP value of 2.91834 suggests moderate lipophilicity, balancing water solubility and membrane permeability for {6-amino-2-[(3,4-dimethylphenyl)amino]-5-nitropyrimidin-4-yl}(oxolan-2-ylmethy l)amine. The TPSA of 128.23 Ų falls within the moderate polarity range, balancing permeability and solubility for {6-amino-2-[(3,4-dimethylphenyl)amino]-5-nitropyrimidin-4-yl}(oxolan-2-ylmethy l)amine. Following Lipinski's Rule of Five, {6-amino-2-[(3,4-dimethylphenyl)amino]-5-nitropyrimidin-4-yl}(oxolan-2-ylmethy l)amine 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 {6-amino-2-[(3,4-dimethylphenyl)amino]-5-nitropyrimidin-4-yl}(oxolan-2-ylmethy l)amine?
The CAS number of {6-amino-2-[(3,4-dimethylphenyl)amino]-5-nitropyrimidin-4-yl}(oxolan-2-ylmethy l)amine is 586994-07-2.
What is the molecular formula of {6-amino-2-[(3,4-dimethylphenyl)amino]-5-nitropyrimidin-4-yl}(oxolan-2-ylmethy l)amine?
The molecular formula of {6-amino-2-[(3,4-dimethylphenyl)amino]-5-nitropyrimidin-4-yl}(oxolan-2-ylmethy l)amine is C17H22N6O3.
What is the molecular weight of {6-amino-2-[(3,4-dimethylphenyl)amino]-5-nitropyrimidin-4-yl}(oxolan-2-ylmethy l)amine?
The molecular weight of {6-amino-2-[(3,4-dimethylphenyl)amino]-5-nitropyrimidin-4-yl}(oxolan-2-ylmethy l)amine is 358.18 g/mol.
Where can I buy {6-amino-2-[(3,4-dimethylphenyl)amino]-5-nitropyrimidin-4-yl}(oxolan-2-ylmethy l)amine?
You can request a quote for {6-amino-2-[(3,4-dimethylphenyl)amino]-5-nitropyrimidin-4-yl}(oxolan-2-ylmethy l)amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for {6-amino-2-[(3,4-dimethylphenyl)amino]-5-nitropyrimidin-4-yl}(oxolan-2-ylmethy l)amine?
Yes, KEHONG BIO provides custom synthesis services for {6-amino-2-[(3,4-dimethylphenyl)amino]-5-nitropyrimidin-4-yl}(oxolan-2-ylmethy l)amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.