![N4-[4-(4-Chlorophenoxy)phenyl]-5-nitropyrimidine-4,6-diamine structure](/static/products/4503/450345-18-3.webp)
N4-[4-(4-Chlorophenoxy)phenyl]-5-nitropyrimidine-4,6-diamine
TL;DR: N4-[4-(4-Chlorophenoxy)phenyl]-5-nitropyrimidine-4,6-diamine (CAS 450345-18-3) is a chemical compound with molecular formula C16H12ClN5O3 and molecular weight 357.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-N-[4-(4-chlorophenoxy)phenyl]-5-nitropyrimidine-4,6-diamine
Also Known As: AB00358623-02, F0543-0098, N-[4-(4-chlorophenoxy)phenyl]-5-nitropyrimidine-4,6-diamine, N4-[4-(4-CHLOROPHENOXY)PHENYL]-5-NITROPYRIMIDINE-4,6-DIAMINE, 4-N-[4-(4-chlorophenoxy)phenyl]-5-nitropyrimidine-4,6-diamine
| Molecular Formula | C16H12ClN5O3 |
|---|---|
| Molecular Weight | 357.06 g/mol |
| LogP | 4.1563 |
| Topological Polar Surface Area | 116.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 357.06287 |
| Heavy Atoms | 25 |
| Complexity | 900.6487 |
Chemical Identifiers
| CAS Number | 450345-18-3 |
|---|---|
| SMILES | C1=CC(=CC=C1NC2=NC=NC(=C2[N+](=O)[O-])N)OC3=CC=C(C=C3)Cl |
Product Overview
N4-[4-(4-Chlorophenoxy)phenyl]-5-nitropyrimidine-4,6-diamine (CAS 450345-18-3), with molecular formula C16H12ClN5O3 and molecular weight 357.06 g/mol. IUPAC: 4-N-[4-(4-chlorophenoxy)phenyl]-5-nitropyrimidine-4,6-diamine.
Chemical Property Profile of N4-[4-(4-Chlorophenoxy)phenyl]-5-nitropyrimidine-4,6-diamine
Property Insights of N4-[4-(4-Chlorophenoxy)phenyl]-5-nitropyrimidine-4,6-diamine
The XLogP value of 4.1563 indicates that N4-[4-(4-Chlorophenoxy)phenyl]-5-nitropyrimidine-4,6-diamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 116.2 Ų falls within the moderate polarity range, balancing permeability and solubility for N4-[4-(4-Chlorophenoxy)phenyl]-5-nitropyrimidine-4,6-diamine. Following Lipinski's Rule of Five, N4-[4-(4-Chlorophenoxy)phenyl]-5-nitropyrimidine-4,6-diamine has 2 hydrogen bond donor(s) and 7 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 N4-[4-(4-Chlorophenoxy)phenyl]-5-nitropyrimidine-4,6-diamine?
The CAS number of N4-[4-(4-Chlorophenoxy)phenyl]-5-nitropyrimidine-4,6-diamine is 450345-18-3.
What is the molecular formula of N4-[4-(4-Chlorophenoxy)phenyl]-5-nitropyrimidine-4,6-diamine?
The molecular formula of N4-[4-(4-Chlorophenoxy)phenyl]-5-nitropyrimidine-4,6-diamine is C16H12ClN5O3.
What is the molecular weight of N4-[4-(4-Chlorophenoxy)phenyl]-5-nitropyrimidine-4,6-diamine?
The molecular weight of N4-[4-(4-Chlorophenoxy)phenyl]-5-nitropyrimidine-4,6-diamine is 357.06 g/mol.
Where can I buy N4-[4-(4-Chlorophenoxy)phenyl]-5-nitropyrimidine-4,6-diamine?
You can request a quote for N4-[4-(4-Chlorophenoxy)phenyl]-5-nitropyrimidine-4,6-diamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N4-[4-(4-Chlorophenoxy)phenyl]-5-nitropyrimidine-4,6-diamine?
Yes, KEHONG BIO provides custom synthesis services for N4-[4-(4-Chlorophenoxy)phenyl]-5-nitropyrimidine-4,6-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.