N,N'-bis(3-chlorophenyl)-5-fluoropyrimidine-2,4-diamine
TL;DR: N,N'-bis(3-chlorophenyl)-5-fluoropyrimidine-2,4-diamine (CAS 313240-30-1) is a chemical compound with molecular formula C16H11Cl2FN4 and molecular weight 348.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-N,4-N-bis(3-chlorophenyl)-5-fluoropyrimidine-2,4-diamine
Also Known As: BAS 03189218, 2-N,4-N-bis(3-chlorophenyl)-5-fluoropyrimidine-2,4-diamine, N2,N4-BIS(3-CHLOROPHENYL)-5-FLUOROPYRIMIDINE-2,4-DIAMINE, N,N'-bis(3-chlorophenyl)-5-fluoropyrimidine-2,4-diamine, N2,N4-bis(3-chlorophenyl)-5-fluoro-2,4-pyrimidinediamine
| Molecular Formula | C16H11Cl2FN4 |
|---|---|
| Molecular Weight | 348.03 g/mol |
| LogP | 5.3 |
| Topological Polar Surface Area | 49.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 348.0345 |
| Heavy Atoms | 23 |
| Complexity | 376.0 |
Chemical Identifiers
| CAS Number | 313240-30-1 |
|---|---|
| SMILES | C1=CC(=CC(=C1)Cl)NC2=NC(=NC=C2F)NC3=CC(=CC=C3)Cl |
| InChIKey | RUPMYJYSOQCMBT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N,N'-bis(3-chlorophenyl)-5-fluoropyrimidine-2,4-diamine (CAS 313240-30-1), with molecular formula C16H11Cl2FN4 and molecular weight 348.03 g/mol. IUPAC: 2-N,4-N-bis(3-chlorophenyl)-5-fluoropyrimidine-2,4-diamine.
Chemical Property Profile of N,N'-bis(3-chlorophenyl)-5-fluoropyrimidine-2,4-diamine
Property Insights of N,N'-bis(3-chlorophenyl)-5-fluoropyrimidine-2,4-diamine
The XLogP value of 5.3 indicates that N,N'-bis(3-chlorophenyl)-5-fluoropyrimidine-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, N,N'-bis(3-chlorophenyl)-5-fluoropyrimidine-2,4-diamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N'-bis(3-chlorophenyl)-5-fluoropyrimidine-2,4-diamine has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N,N'-bis(3-chlorophenyl)-5-fluoropyrimidine-2,4-diamine?
The CAS number of N,N'-bis(3-chlorophenyl)-5-fluoropyrimidine-2,4-diamine is 313240-30-1.
What is the molecular formula of N,N'-bis(3-chlorophenyl)-5-fluoropyrimidine-2,4-diamine?
The molecular formula of N,N'-bis(3-chlorophenyl)-5-fluoropyrimidine-2,4-diamine is C16H11Cl2FN4.
What is the molecular weight of N,N'-bis(3-chlorophenyl)-5-fluoropyrimidine-2,4-diamine?
The molecular weight of N,N'-bis(3-chlorophenyl)-5-fluoropyrimidine-2,4-diamine is 348.03 g/mol.
Where can I buy N,N'-bis(3-chlorophenyl)-5-fluoropyrimidine-2,4-diamine?
You can request a quote for N,N'-bis(3-chlorophenyl)-5-fluoropyrimidine-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 N,N'-bis(3-chlorophenyl)-5-fluoropyrimidine-2,4-diamine?
Yes, KEHONG BIO provides custom synthesis services for N,N'-bis(3-chlorophenyl)-5-fluoropyrimidine-2,4-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.