![6-Chloro-2-[(3-iodophenyl)methylsulfanyl]pyrimidin-4-amine structure](/static/products/166/166751-71-9.png)
6-Chloro-2-[(3-iodophenyl)methylsulfanyl]pyrimidin-4-amine
TL;DR: 6-Chloro-2-[(3-iodophenyl)methylsulfanyl]pyrimidin-4-amine (CAS 166751-71-9) is a chemical compound with molecular formula C11H9ClIN3S and molecular weight 376.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-2-[(3-iodophenyl)methylsulfanyl]pyrimidin-4-amine
Also Known As: Pyrimidine analog, J1.016.765E, 2-(3-Iodobenzylthio)-6-chloropyrimidine-4-amine, 4-Pyrimidinamine, 6-chloro-2-[[(3-iodophenyl)methyl]thio]-, 6-chloro-2-[(3-iodobenzyl)sulfanyl]pyrimidin-4-amine
| Molecular Formula | C11H9ClIN3S |
|---|---|
| Molecular Weight | 376.93 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 77.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 376.92505 |
| Heavy Atoms | 17 |
| Complexity | 247.0 |
Chemical Identifiers
| CAS Number | 166751-71-9 |
|---|---|
| SMILES | C1=CC(=CC(=C1)I)CSC2=NC(=CC(=N2)Cl)N |
| InChIKey | VBECYBPCLCAMRD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
6-Chloro-2-[(3-iodophenyl)methylsulfanyl]pyrimidin-4-amine (CAS 166751-71-9), with molecular formula C11H9ClIN3S and molecular weight 376.93 g/mol. IUPAC: 6-chloro-2-[(3-iodophenyl)methylsulfanyl]pyrimidin-4-amine.
Chemical Property Profile of 6-Chloro-2-[(3-iodophenyl)methylsulfanyl]pyrimidin-4-amine
Property Insights of 6-Chloro-2-[(3-iodophenyl)methylsulfanyl]pyrimidin-4-amine
The XLogP value of 3.8 indicates that 6-Chloro-2-[(3-iodophenyl)methylsulfanyl]pyrimidin-4-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Chloro-2-[(3-iodophenyl)methylsulfanyl]pyrimidin-4-amine. Following Lipinski's Rule of Five, 6-Chloro-2-[(3-iodophenyl)methylsulfanyl]pyrimidin-4-amine has 1 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 6-Chloro-2-[(3-iodophenyl)methylsulfanyl]pyrimidin-4-amine?
The CAS number of 6-Chloro-2-[(3-iodophenyl)methylsulfanyl]pyrimidin-4-amine is 166751-71-9.
What is the molecular formula of 6-Chloro-2-[(3-iodophenyl)methylsulfanyl]pyrimidin-4-amine?
The molecular formula of 6-Chloro-2-[(3-iodophenyl)methylsulfanyl]pyrimidin-4-amine is C11H9ClIN3S.
What is the molecular weight of 6-Chloro-2-[(3-iodophenyl)methylsulfanyl]pyrimidin-4-amine?
The molecular weight of 6-Chloro-2-[(3-iodophenyl)methylsulfanyl]pyrimidin-4-amine is 376.93 g/mol.
Where can I buy 6-Chloro-2-[(3-iodophenyl)methylsulfanyl]pyrimidin-4-amine?
You can request a quote for 6-Chloro-2-[(3-iodophenyl)methylsulfanyl]pyrimidin-4-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Chloro-2-[(3-iodophenyl)methylsulfanyl]pyrimidin-4-amine?
Yes, KEHONG BIO provides custom synthesis services for 6-Chloro-2-[(3-iodophenyl)methylsulfanyl]pyrimidin-4-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.