5-fluoro-2-N,4-N-diphenylpyrimidine-2,4-diamine
TL;DR: 5-fluoro-2-N,4-N-diphenylpyrimidine-2,4-diamine (CAS 40423-75-4) is a chemical compound with molecular formula C16H13FN4 and molecular weight 280.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-fluoro-2-N,4-N-diphenylpyrimidine-2,4-diamine
Also Known As: 2,4-Bisanilinopyrimidine, 16, 2,4-dianilino-5-fluoropyrimidine, 5-fluoro-2-N,4-N-diphenylpyrimidine-2,4-diamine, BAS 00550181, 5-fluoro-N,N'-diphenylpyrimidine-2,4-diamine
| Molecular Formula | C16H13FN4 |
|---|---|
| Molecular Weight | 280.11 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 49.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 280.11243 |
| Heavy Atoms | 21 |
| Complexity | 303.0 |
Chemical Identifiers
| CAS Number | 40423-75-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC2=NC(=NC=C2F)NC3=CC=CC=C3 |
| InChIKey | IOBVCHJTLVPPBR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-fluoro-2-N,4-N-diphenylpyrimidine-2,4-diamine (CAS 40423-75-4), with molecular formula C16H13FN4 and molecular weight 280.11 g/mol. IUPAC: 5-fluoro-2-N,4-N-diphenylpyrimidine-2,4-diamine.
Chemical Property Profile of 5-fluoro-2-N,4-N-diphenylpyrimidine-2,4-diamine
Property Insights of 5-fluoro-2-N,4-N-diphenylpyrimidine-2,4-diamine
The XLogP value of 4.1 indicates that 5-fluoro-2-N,4-N-diphenylpyrimidine-2,4-diamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.8 Ų, 5-fluoro-2-N,4-N-diphenylpyrimidine-2,4-diamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-fluoro-2-N,4-N-diphenylpyrimidine-2,4-diamine 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 5-fluoro-2-N,4-N-diphenylpyrimidine-2,4-diamine?
The CAS number of 5-fluoro-2-N,4-N-diphenylpyrimidine-2,4-diamine is 40423-75-4.
What is the molecular formula of 5-fluoro-2-N,4-N-diphenylpyrimidine-2,4-diamine?
The molecular formula of 5-fluoro-2-N,4-N-diphenylpyrimidine-2,4-diamine is C16H13FN4.
What is the molecular weight of 5-fluoro-2-N,4-N-diphenylpyrimidine-2,4-diamine?
The molecular weight of 5-fluoro-2-N,4-N-diphenylpyrimidine-2,4-diamine is 280.11 g/mol.
Where can I buy 5-fluoro-2-N,4-N-diphenylpyrimidine-2,4-diamine?
You can request a quote for 5-fluoro-2-N,4-N-diphenylpyrimidine-2,4-diamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-fluoro-2-N,4-N-diphenylpyrimidine-2,4-diamine?
Yes, KEHONG BIO provides custom synthesis services for 5-fluoro-2-N,4-N-diphenylpyrimidine-2,4-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.