4-(4-Chlorophenyl)-2-(phenylsulfanyl)pyrimidine
TL;DR: 4-(4-Chlorophenyl)-2-(phenylsulfanyl)pyrimidine (CAS 339106-03-5) is a chemical compound with molecular formula C16H11ClN2S and molecular weight 298.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-chlorophenyl)-2-phenylsulfanylpyrimidine
Also Known As: 4-(4-chlorophenyl)-2-(phenylsulfanyl)pyrimidine, 4-(4-chlorophenyl)-2-phenylsulfanylpyrimidine, 8N-506S
| Molecular Formula | C16H11ClN2S |
|---|---|
| Molecular Weight | 298.03 g/mol |
| LogP | 4.9482 |
| Topological Polar Surface Area | 25.78 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 298.03314 |
| Heavy Atoms | 20 |
| Complexity | 699.1824 |
Chemical Identifiers
| CAS Number | 339106-03-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)SC2=NC=CC(=N2)C3=CC=C(C=C3)Cl |
Product Overview
4-(4-Chlorophenyl)-2-(phenylsulfanyl)pyrimidine (CAS 339106-03-5), with molecular formula C16H11ClN2S and molecular weight 298.03 g/mol. IUPAC: 4-(4-chlorophenyl)-2-phenylsulfanylpyrimidine.
Chemical Property Profile of 4-(4-Chlorophenyl)-2-(phenylsulfanyl)pyrimidine
Property Insights of 4-(4-Chlorophenyl)-2-(phenylsulfanyl)pyrimidine
The XLogP value of 4.9482 indicates that 4-(4-Chlorophenyl)-2-(phenylsulfanyl)pyrimidine 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-(4-Chlorophenyl)-2-(phenylsulfanyl)pyrimidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(4-Chlorophenyl)-2-(phenylsulfanyl)pyrimidine has 0 hydrogen bond donor(s) and 3 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-(4-Chlorophenyl)-2-(phenylsulfanyl)pyrimidine?
The CAS number of 4-(4-Chlorophenyl)-2-(phenylsulfanyl)pyrimidine is 339106-03-5.
What is the molecular formula of 4-(4-Chlorophenyl)-2-(phenylsulfanyl)pyrimidine?
The molecular formula of 4-(4-Chlorophenyl)-2-(phenylsulfanyl)pyrimidine is C16H11ClN2S.
What is the molecular weight of 4-(4-Chlorophenyl)-2-(phenylsulfanyl)pyrimidine?
The molecular weight of 4-(4-Chlorophenyl)-2-(phenylsulfanyl)pyrimidine is 298.03 g/mol.
Where can I buy 4-(4-Chlorophenyl)-2-(phenylsulfanyl)pyrimidine?
You can request a quote for 4-(4-Chlorophenyl)-2-(phenylsulfanyl)pyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(4-Chlorophenyl)-2-(phenylsulfanyl)pyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-Chlorophenyl)-2-(phenylsulfanyl)pyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.