5-(2,4-Dichlorobenzyl)-2-phenyl-4,6-pyrimidinediamine
TL;DR: 5-(2,4-Dichlorobenzyl)-2-phenyl-4,6-pyrimidinediamine (CAS 338965-13-2) is a chemical compound with molecular formula C17H14Cl2N4 and molecular weight 344.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(2,4-dichlorophenyl)methyl]-2-phenylpyrimidine-4,6-diamine
Also Known As: 5-(2,4-dichlorobenzyl)-2-phenyl-4,6-pyrimidinediamine, 5-[(2,4-dichlorophenyl)methyl]-2-phenylpyrimidine-4,6-diamine, 5-[(2,4-dichlorophenyl)methyl]-2-phenyl-pyrimidine-4,6-diamine, C17H14Cl2N4
| Molecular Formula | C17H14Cl2N4 |
|---|---|
| Molecular Weight | 344.06 g/mol |
| LogP | 4.2056 |
| Topological Polar Surface Area | 77.82 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 344.05954 |
| Heavy Atoms | 23 |
| Complexity | 827.4623 |
Chemical Identifiers
| CAS Number | 338965-13-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=NC(=C(C(=N2)N)CC3=C(C=C(C=C3)Cl)Cl)N |
Product Overview
5-(2,4-Dichlorobenzyl)-2-phenyl-4,6-pyrimidinediamine (CAS 338965-13-2), with molecular formula C17H14Cl2N4 and molecular weight 344.06 g/mol. IUPAC: 5-[(2,4-dichlorophenyl)methyl]-2-phenylpyrimidine-4,6-diamine.
Chemical Property Profile of 5-(2,4-Dichlorobenzyl)-2-phenyl-4,6-pyrimidinediamine
Property Insights of 5-(2,4-Dichlorobenzyl)-2-phenyl-4,6-pyrimidinediamine
The XLogP value of 4.2056 indicates that 5-(2,4-Dichlorobenzyl)-2-phenyl-4,6-pyrimidinediamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.82 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(2,4-Dichlorobenzyl)-2-phenyl-4,6-pyrimidinediamine. Following Lipinski's Rule of Five, 5-(2,4-Dichlorobenzyl)-2-phenyl-4,6-pyrimidinediamine has 2 hydrogen bond donor(s) and 4 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-(2,4-Dichlorobenzyl)-2-phenyl-4,6-pyrimidinediamine?
The CAS number of 5-(2,4-Dichlorobenzyl)-2-phenyl-4,6-pyrimidinediamine is 338965-13-2.
What is the molecular formula of 5-(2,4-Dichlorobenzyl)-2-phenyl-4,6-pyrimidinediamine?
The molecular formula of 5-(2,4-Dichlorobenzyl)-2-phenyl-4,6-pyrimidinediamine is C17H14Cl2N4.
What is the molecular weight of 5-(2,4-Dichlorobenzyl)-2-phenyl-4,6-pyrimidinediamine?
The molecular weight of 5-(2,4-Dichlorobenzyl)-2-phenyl-4,6-pyrimidinediamine is 344.06 g/mol.
Where can I buy 5-(2,4-Dichlorobenzyl)-2-phenyl-4,6-pyrimidinediamine?
You can request a quote for 5-(2,4-Dichlorobenzyl)-2-phenyl-4,6-pyrimidinediamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(2,4-Dichlorobenzyl)-2-phenyl-4,6-pyrimidinediamine?
Yes, KEHONG BIO provides custom synthesis services for 5-(2,4-Dichlorobenzyl)-2-phenyl-4,6-pyrimidinediamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.