4-Chloro-6-(((4-chlorobenzyl)thio)methyl)-2-phenylpyrimidine
TL;DR: 4-Chloro-6-(((4-chlorobenzyl)thio)methyl)-2-phenylpyrimidine (CAS 339279-19-5) is a chemical compound with molecular formula C18H14Cl2N2S and molecular weight 360.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-6-[(4-chlorophenyl)methylsulfanylmethyl]-2-phenylpyrimidine
Also Known As: Bionet1_002369, 4-Chloro-6-(((4-chlorobenzyl)thio)methyl)-2-phenylpyrimidine, 4-chlorobenzyl (6-chloro-2-phenyl-4-pyrimidinyl)methyl sulfide, 4L-603S, 4-Chlorobenzyl (6-chloro-2-phenyl-4-pyrimidinyl)-methyl sulfide
| Molecular Formula | C18H14Cl2N2S |
|---|---|
| Molecular Weight | 360.03 g/mol |
| LogP | 5.8838 |
| Topological Polar Surface Area | 25.78 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 360.02548 |
| Heavy Atoms | 23 |
| Complexity | 776.78485 |
Chemical Identifiers
| CAS Number | 339279-19-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=NC(=CC(=N2)Cl)CSCC3=CC=C(C=C3)Cl |
Product Overview
4-Chloro-6-(((4-chlorobenzyl)thio)methyl)-2-phenylpyrimidine (CAS 339279-19-5), with molecular formula C18H14Cl2N2S and molecular weight 360.03 g/mol. IUPAC: 4-chloro-6-[(4-chlorophenyl)methylsulfanylmethyl]-2-phenylpyrimidine.
Chemical Property Profile of 4-Chloro-6-(((4-chlorobenzyl)thio)methyl)-2-phenylpyrimidine
Property Insights of 4-Chloro-6-(((4-chlorobenzyl)thio)methyl)-2-phenylpyrimidine
The XLogP value of 5.8838 indicates that 4-Chloro-6-(((4-chlorobenzyl)thio)methyl)-2-phenylpyrimidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 25.78 Ų, 4-Chloro-6-(((4-chlorobenzyl)thio)methyl)-2-phenylpyrimidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Chloro-6-(((4-chlorobenzyl)thio)methyl)-2-phenylpyrimidine has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-Chloro-6-(((4-chlorobenzyl)thio)methyl)-2-phenylpyrimidine?
The CAS number of 4-Chloro-6-(((4-chlorobenzyl)thio)methyl)-2-phenylpyrimidine is 339279-19-5.
What is the molecular formula of 4-Chloro-6-(((4-chlorobenzyl)thio)methyl)-2-phenylpyrimidine?
The molecular formula of 4-Chloro-6-(((4-chlorobenzyl)thio)methyl)-2-phenylpyrimidine is C18H14Cl2N2S.
What is the molecular weight of 4-Chloro-6-(((4-chlorobenzyl)thio)methyl)-2-phenylpyrimidine?
The molecular weight of 4-Chloro-6-(((4-chlorobenzyl)thio)methyl)-2-phenylpyrimidine is 360.03 g/mol.
Where can I buy 4-Chloro-6-(((4-chlorobenzyl)thio)methyl)-2-phenylpyrimidine?
You can request a quote for 4-Chloro-6-(((4-chlorobenzyl)thio)methyl)-2-phenylpyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Chloro-6-(((4-chlorobenzyl)thio)methyl)-2-phenylpyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 4-Chloro-6-(((4-chlorobenzyl)thio)methyl)-2-phenylpyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.