N-[4-ethyl-5-(2-hydroxyphenyl)-6-phenylpyrimidin-2-yl]nitramide
TL;DR: N-[4-ethyl-5-(2-hydroxyphenyl)-6-phenylpyrimidin-2-yl]nitramide (CAS 53511-39-0) is a chemical compound with molecular formula C18H16N4O3 and molecular weight 336.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-ethyl-5-(2-hydroxyphenyl)-6-phenylpyrimidin-2-yl]nitramide
Also Known As: N-[4-ethyl-5-(2-hydroxyphenyl)-6-phenylpyrimidin-2-yl]nitramide
| Molecular Formula | C18H16N4O3 |
|---|---|
| Molecular Weight | 336.12 g/mol |
| LogP | 3.6822 |
| Topological Polar Surface Area | 101.18 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 336.12225 |
| Heavy Atoms | 25 |
| Complexity | 913.44965 |
Chemical Identifiers
| CAS Number | 53511-39-0 |
|---|---|
| SMILES | CCC1=C(C(=NC(=N1)N[N+](=O)[O-])C2=CC=CC=C2)C3=CC=CC=C3O |
Product Overview
N-[4-ethyl-5-(2-hydroxyphenyl)-6-phenylpyrimidin-2-yl]nitramide (CAS 53511-39-0), with molecular formula C18H16N4O3 and molecular weight 336.12 g/mol. IUPAC: N-[4-ethyl-5-(2-hydroxyphenyl)-6-phenylpyrimidin-2-yl]nitramide.
Chemical Property Profile of N-[4-ethyl-5-(2-hydroxyphenyl)-6-phenylpyrimidin-2-yl]nitramide
Property Insights of N-[4-ethyl-5-(2-hydroxyphenyl)-6-phenylpyrimidin-2-yl]nitramide
The XLogP value of 3.6822 indicates that N-[4-ethyl-5-(2-hydroxyphenyl)-6-phenylpyrimidin-2-yl]nitramide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.18 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[4-ethyl-5-(2-hydroxyphenyl)-6-phenylpyrimidin-2-yl]nitramide. Following Lipinski's Rule of Five, N-[4-ethyl-5-(2-hydroxyphenyl)-6-phenylpyrimidin-2-yl]nitramide has 2 hydrogen bond donor(s) and 5 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 N-[4-ethyl-5-(2-hydroxyphenyl)-6-phenylpyrimidin-2-yl]nitramide?
The CAS number of N-[4-ethyl-5-(2-hydroxyphenyl)-6-phenylpyrimidin-2-yl]nitramide is 53511-39-0.
What is the molecular formula of N-[4-ethyl-5-(2-hydroxyphenyl)-6-phenylpyrimidin-2-yl]nitramide?
The molecular formula of N-[4-ethyl-5-(2-hydroxyphenyl)-6-phenylpyrimidin-2-yl]nitramide is C18H16N4O3.
What is the molecular weight of N-[4-ethyl-5-(2-hydroxyphenyl)-6-phenylpyrimidin-2-yl]nitramide?
The molecular weight of N-[4-ethyl-5-(2-hydroxyphenyl)-6-phenylpyrimidin-2-yl]nitramide is 336.12 g/mol.
Where can I buy N-[4-ethyl-5-(2-hydroxyphenyl)-6-phenylpyrimidin-2-yl]nitramide?
You can request a quote for N-[4-ethyl-5-(2-hydroxyphenyl)-6-phenylpyrimidin-2-yl]nitramide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[4-ethyl-5-(2-hydroxyphenyl)-6-phenylpyrimidin-2-yl]nitramide?
Yes, KEHONG BIO provides custom synthesis services for N-[4-ethyl-5-(2-hydroxyphenyl)-6-phenylpyrimidin-2-yl]nitramide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.