5-Nitro-6-(2,3,5-trimethylphenoxy)pyrimidin-4-amine
TL;DR: 5-Nitro-6-(2,3,5-trimethylphenoxy)pyrimidin-4-amine (CAS 497063-54-4) is a chemical compound with molecular formula C13H14N4O3 and molecular weight 274.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-nitro-6-(2,3,5-trimethylphenoxy)pyrimidin-4-amine
Also Known As: 5-nitro-6-(2,3,5-trimethylphenoxy)pyrimidin-4-amine, 5-nitro-6-(2,3,5-trimethylphenoxy)-4-pyrimidinamine, AB00357011-03, F0543-0331
| Molecular Formula | C13H14N4O3 |
|---|---|
| Molecular Weight | 274.11 g/mol |
| LogP | 2.68456 |
| Topological Polar Surface Area | 104.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 274.1066 |
| Heavy Atoms | 20 |
| Complexity | 685.55676 |
Chemical Identifiers
| CAS Number | 497063-54-4 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1)OC2=NC=NC(=C2[N+](=O)[O-])N)C)C |
Product Overview
5-Nitro-6-(2,3,5-trimethylphenoxy)pyrimidin-4-amine (CAS 497063-54-4), with molecular formula C13H14N4O3 and molecular weight 274.11 g/mol. IUPAC: 5-nitro-6-(2,3,5-trimethylphenoxy)pyrimidin-4-amine.
Chemical Property Profile of 5-Nitro-6-(2,3,5-trimethylphenoxy)pyrimidin-4-amine
Property Insights of 5-Nitro-6-(2,3,5-trimethylphenoxy)pyrimidin-4-amine
The XLogP value of 2.68456 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Nitro-6-(2,3,5-trimethylphenoxy)pyrimidin-4-amine. The TPSA of 104.17 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Nitro-6-(2,3,5-trimethylphenoxy)pyrimidin-4-amine. Following Lipinski's Rule of Five, 5-Nitro-6-(2,3,5-trimethylphenoxy)pyrimidin-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 5-Nitro-6-(2,3,5-trimethylphenoxy)pyrimidin-4-amine?
The CAS number of 5-Nitro-6-(2,3,5-trimethylphenoxy)pyrimidin-4-amine is 497063-54-4.
What is the molecular formula of 5-Nitro-6-(2,3,5-trimethylphenoxy)pyrimidin-4-amine?
The molecular formula of 5-Nitro-6-(2,3,5-trimethylphenoxy)pyrimidin-4-amine is C13H14N4O3.
What is the molecular weight of 5-Nitro-6-(2,3,5-trimethylphenoxy)pyrimidin-4-amine?
The molecular weight of 5-Nitro-6-(2,3,5-trimethylphenoxy)pyrimidin-4-amine is 274.11 g/mol.
Where can I buy 5-Nitro-6-(2,3,5-trimethylphenoxy)pyrimidin-4-amine?
You can request a quote for 5-Nitro-6-(2,3,5-trimethylphenoxy)pyrimidin-4-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Nitro-6-(2,3,5-trimethylphenoxy)pyrimidin-4-amine?
Yes, KEHONG BIO provides custom synthesis services for 5-Nitro-6-(2,3,5-trimethylphenoxy)pyrimidin-4-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.