6-(3,4-Dimethylphenoxy)-5-nitropyrimidin-4-amine
TL;DR: 6-(3,4-Dimethylphenoxy)-5-nitropyrimidin-4-amine (CAS 497063-53-3) is a chemical compound with molecular formula C12H12N4O3 and molecular weight 260.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(3,4-dimethylphenoxy)-5-nitropyrimidin-4-amine
Also Known As: 6-(3,4-dimethylphenoxy)-5-nitropyrimidin-4-amine, 6-(3,4-dimethylphenoxy)-5-nitro-4-pyrimidinamine
| Molecular Formula | C12H12N4O3 |
|---|---|
| Molecular Weight | 260.09 g/mol |
| LogP | 2.37614 |
| Topological Polar Surface Area | 104.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 260.09094 |
| Heavy Atoms | 19 |
| Complexity | 642.86676 |
Chemical Identifiers
| CAS Number | 497063-53-3 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)OC2=NC=NC(=C2[N+](=O)[O-])N)C |
Product Overview
6-(3,4-Dimethylphenoxy)-5-nitropyrimidin-4-amine (CAS 497063-53-3), with molecular formula C12H12N4O3 and molecular weight 260.09 g/mol. IUPAC: 6-(3,4-dimethylphenoxy)-5-nitropyrimidin-4-amine.
Chemical Property Profile of 6-(3,4-Dimethylphenoxy)-5-nitropyrimidin-4-amine
Property Insights of 6-(3,4-Dimethylphenoxy)-5-nitropyrimidin-4-amine
The XLogP value of 2.37614 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-(3,4-Dimethylphenoxy)-5-nitropyrimidin-4-amine. The TPSA of 104.17 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-(3,4-Dimethylphenoxy)-5-nitropyrimidin-4-amine. Following Lipinski's Rule of Five, 6-(3,4-Dimethylphenoxy)-5-nitropyrimidin-4-amine has 1 hydrogen bond donor(s) and 6 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-(3,4-Dimethylphenoxy)-5-nitropyrimidin-4-amine?
The CAS number of 6-(3,4-Dimethylphenoxy)-5-nitropyrimidin-4-amine is 497063-53-3.
What is the molecular formula of 6-(3,4-Dimethylphenoxy)-5-nitropyrimidin-4-amine?
The molecular formula of 6-(3,4-Dimethylphenoxy)-5-nitropyrimidin-4-amine is C12H12N4O3.
What is the molecular weight of 6-(3,4-Dimethylphenoxy)-5-nitropyrimidin-4-amine?
The molecular weight of 6-(3,4-Dimethylphenoxy)-5-nitropyrimidin-4-amine is 260.09 g/mol.
Where can I buy 6-(3,4-Dimethylphenoxy)-5-nitropyrimidin-4-amine?
You can request a quote for 6-(3,4-Dimethylphenoxy)-5-nitropyrimidin-4-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-(3,4-Dimethylphenoxy)-5-nitropyrimidin-4-amine?
Yes, KEHONG BIO provides custom synthesis services for 6-(3,4-Dimethylphenoxy)-5-nitropyrimidin-4-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.