6-(3-Isopropyl-5-methylphenoxy)-5-nitropyrimidin-4-amine
TL;DR: 6-(3-Isopropyl-5-methylphenoxy)-5-nitropyrimidin-4-amine (CAS 497063-52-2) is a chemical compound with molecular formula C14H16N4O3 and molecular weight 288.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(3-methyl-5-propan-2-ylphenoxy)-5-nitropyrimidin-4-amine
Also Known As: 6-(3-isopropyl-5-methylphenoxy)-5-nitropyrimidin-4-amine, AB00357362-02, 6-[3-methyl-5-(propan-2-yl)phenoxy]-5-nitropyrimidin-4-amine, 6-(3-methyl-5-propan-2-ylphenoxy)-5-nitropyrimidin-4-amine, F0543-0325
| Molecular Formula | C14H16N4O3 |
|---|---|
| Molecular Weight | 288.12 g/mol |
| LogP | 3.19112 |
| Topological Polar Surface Area | 104.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 288.12225 |
| Heavy Atoms | 21 |
| Complexity | 685.9145 |
Chemical Identifiers
| CAS Number | 497063-52-2 |
|---|---|
| SMILES | CC1=CC(=CC(=C1)OC2=NC=NC(=C2[N+](=O)[O-])N)C(C)C |
Product Overview
6-(3-Isopropyl-5-methylphenoxy)-5-nitropyrimidin-4-amine (CAS 497063-52-2), with molecular formula C14H16N4O3 and molecular weight 288.12 g/mol. IUPAC: 6-(3-methyl-5-propan-2-ylphenoxy)-5-nitropyrimidin-4-amine.
Chemical Property Profile of 6-(3-Isopropyl-5-methylphenoxy)-5-nitropyrimidin-4-amine
Property Insights of 6-(3-Isopropyl-5-methylphenoxy)-5-nitropyrimidin-4-amine
The XLogP value of 3.19112 indicates that 6-(3-Isopropyl-5-methylphenoxy)-5-nitropyrimidin-4-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 104.17 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-(3-Isopropyl-5-methylphenoxy)-5-nitropyrimidin-4-amine. Following Lipinski's Rule of Five, 6-(3-Isopropyl-5-methylphenoxy)-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-Isopropyl-5-methylphenoxy)-5-nitropyrimidin-4-amine?
The CAS number of 6-(3-Isopropyl-5-methylphenoxy)-5-nitropyrimidin-4-amine is 497063-52-2.
What is the molecular formula of 6-(3-Isopropyl-5-methylphenoxy)-5-nitropyrimidin-4-amine?
The molecular formula of 6-(3-Isopropyl-5-methylphenoxy)-5-nitropyrimidin-4-amine is C14H16N4O3.
What is the molecular weight of 6-(3-Isopropyl-5-methylphenoxy)-5-nitropyrimidin-4-amine?
The molecular weight of 6-(3-Isopropyl-5-methylphenoxy)-5-nitropyrimidin-4-amine is 288.12 g/mol.
Where can I buy 6-(3-Isopropyl-5-methylphenoxy)-5-nitropyrimidin-4-amine?
You can request a quote for 6-(3-Isopropyl-5-methylphenoxy)-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-Isopropyl-5-methylphenoxy)-5-nitropyrimidin-4-amine?
Yes, KEHONG BIO provides custom synthesis services for 6-(3-Isopropyl-5-methylphenoxy)-5-nitropyrimidin-4-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.