![4-(4-Chlorophenyl)-2-[(4-methylphenyl)sulfanyl]pyrimidine structure](/static/products/3391/339105-97-4.webp)
4-(4-Chlorophenyl)-2-[(4-methylphenyl)sulfanyl]pyrimidine
TL;DR: 4-(4-Chlorophenyl)-2-[(4-methylphenyl)sulfanyl]pyrimidine (CAS 339105-97-4) is a chemical compound with molecular formula C17H13ClN2S and molecular weight 312.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-chlorophenyl)-2-(4-methylphenyl)sulfanylpyrimidine
Also Known As: 4-(4-chlorophenyl)-2-[(4-methylphenyl)sulfanyl]pyrimidine, 8N-501S, 4-(4-chlorophenyl)-2-(4-methylphenyl)sulfanylpyrimidine, 4-(4-Chlorophenyl)-2-[(4-methylphenyl)thio]pyrimidine
| Molecular Formula | C17H13ClN2S |
|---|---|
| Molecular Weight | 312.05 g/mol |
| LogP | 5.25662 |
| Topological Polar Surface Area | 25.78 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 312.0488 |
| Heavy Atoms | 21 |
| Complexity | 739.49695 |
Chemical Identifiers
| CAS Number | 339105-97-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)SC2=NC=CC(=N2)C3=CC=C(C=C3)Cl |
Product Overview
4-(4-Chlorophenyl)-2-[(4-methylphenyl)sulfanyl]pyrimidine (CAS 339105-97-4), with molecular formula C17H13ClN2S and molecular weight 312.05 g/mol. IUPAC: 4-(4-chlorophenyl)-2-(4-methylphenyl)sulfanylpyrimidine.
Chemical Property Profile of 4-(4-Chlorophenyl)-2-[(4-methylphenyl)sulfanyl]pyrimidine
Property Insights of 4-(4-Chlorophenyl)-2-[(4-methylphenyl)sulfanyl]pyrimidine
The XLogP value of 5.25662 indicates that 4-(4-Chlorophenyl)-2-[(4-methylphenyl)sulfanyl]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-[(4-methylphenyl)sulfanyl]pyrimidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(4-Chlorophenyl)-2-[(4-methylphenyl)sulfanyl]pyrimidine 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-(4-Chlorophenyl)-2-[(4-methylphenyl)sulfanyl]pyrimidine?
The CAS number of 4-(4-Chlorophenyl)-2-[(4-methylphenyl)sulfanyl]pyrimidine is 339105-97-4.
What is the molecular formula of 4-(4-Chlorophenyl)-2-[(4-methylphenyl)sulfanyl]pyrimidine?
The molecular formula of 4-(4-Chlorophenyl)-2-[(4-methylphenyl)sulfanyl]pyrimidine is C17H13ClN2S.
What is the molecular weight of 4-(4-Chlorophenyl)-2-[(4-methylphenyl)sulfanyl]pyrimidine?
The molecular weight of 4-(4-Chlorophenyl)-2-[(4-methylphenyl)sulfanyl]pyrimidine is 312.05 g/mol.
Where can I buy 4-(4-Chlorophenyl)-2-[(4-methylphenyl)sulfanyl]pyrimidine?
You can request a quote for 4-(4-Chlorophenyl)-2-[(4-methylphenyl)sulfanyl]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-[(4-methylphenyl)sulfanyl]pyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-Chlorophenyl)-2-[(4-methylphenyl)sulfanyl]pyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.