4-N-(4-fluorophenyl)-5-nitropyrimidine-4,6-diamine
TL;DR: 4-N-(4-fluorophenyl)-5-nitropyrimidine-4,6-diamine (CAS 450345-06-9) is a chemical compound with molecular formula C10H8FN5O2 and molecular weight 249.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-N-(4-fluorophenyl)-5-nitropyrimidine-4,6-diamine
Also Known As: 4-N-(4-fluorophenyl)-5-nitropyrimidine-4,6-diamine, N-(4-fluorophenyl)-5-nitropyrimidine-4,6-diamine, N4-(4-fluorophenyl)-5-nitropyrimidine-4,6-diamine, AB00668237-01, F0543-0076
| Molecular Formula | C10H8FN5O2 |
|---|---|
| Molecular Weight | 249.07 g/mol |
| LogP | 1.8497 |
| Topological Polar Surface Area | 106.97 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 249.06621 |
| Heavy Atoms | 18 |
| Complexity | 587.32196 |
Chemical Identifiers
| CAS Number | 450345-06-9 |
|---|---|
| SMILES | C1=CC(=CC=C1NC2=NC=NC(=C2[N+](=O)[O-])N)F |
Product Overview
4-N-(4-fluorophenyl)-5-nitropyrimidine-4,6-diamine (CAS 450345-06-9), with molecular formula C10H8FN5O2 and molecular weight 249.07 g/mol. IUPAC: 4-N-(4-fluorophenyl)-5-nitropyrimidine-4,6-diamine.
Chemical Property Profile of 4-N-(4-fluorophenyl)-5-nitropyrimidine-4,6-diamine
Property Insights of 4-N-(4-fluorophenyl)-5-nitropyrimidine-4,6-diamine
The XLogP value of 1.8497 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-N-(4-fluorophenyl)-5-nitropyrimidine-4,6-diamine. The TPSA of 106.97 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-N-(4-fluorophenyl)-5-nitropyrimidine-4,6-diamine. Following Lipinski's Rule of Five, 4-N-(4-fluorophenyl)-5-nitropyrimidine-4,6-diamine has 2 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 4-N-(4-fluorophenyl)-5-nitropyrimidine-4,6-diamine?
The CAS number of 4-N-(4-fluorophenyl)-5-nitropyrimidine-4,6-diamine is 450345-06-9.
What is the molecular formula of 4-N-(4-fluorophenyl)-5-nitropyrimidine-4,6-diamine?
The molecular formula of 4-N-(4-fluorophenyl)-5-nitropyrimidine-4,6-diamine is C10H8FN5O2.
What is the molecular weight of 4-N-(4-fluorophenyl)-5-nitropyrimidine-4,6-diamine?
The molecular weight of 4-N-(4-fluorophenyl)-5-nitropyrimidine-4,6-diamine is 249.07 g/mol.
Where can I buy 4-N-(4-fluorophenyl)-5-nitropyrimidine-4,6-diamine?
You can request a quote for 4-N-(4-fluorophenyl)-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 4-N-(4-fluorophenyl)-5-nitropyrimidine-4,6-diamine?
Yes, KEHONG BIO provides custom synthesis services for 4-N-(4-fluorophenyl)-5-nitropyrimidine-4,6-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.