![2-[(4-Fluorophenyl)methylthio]pyrimidine-4,6-diamine structure](/static/products/340/340808-48-2.png)
2-[(4-Fluorophenyl)methylthio]pyrimidine-4,6-diamine
TL;DR: 2-[(4-Fluorophenyl)methylthio]pyrimidine-4,6-diamine (CAS 340808-48-2) is a chemical compound with molecular formula C11H11FN4S and molecular weight 250.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-fluorophenyl)methylsulfanyl]pyrimidine-4,6-diamine
Also Known As: 2-(4-fluorobenzylthio)pyrimidine-4,6-diamine, J3.028.338D, 2-[(4-Fluorobenzyl)thio]pyrimidine-4,6-diamine, 2-[(4-fluorophenyl)methylsulfanyl]pyrimidine-4,6-diamine, 2-[(4-fluorophenyl)methylthio]pyrimidine-4,6-diamine
| Molecular Formula | C11H11FN4S |
|---|---|
| Molecular Weight | 250.07 g/mol |
| LogP | 2.0724 |
| Topological Polar Surface Area | 77.82 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 250.06885 |
| Heavy Atoms | 17 |
| Complexity | 495.1299 |
Chemical Identifiers
| CAS Number | 340808-48-2 |
|---|---|
| SMILES | C1=CC(=CC=C1CSC2=NC(=CC(=N2)N)N)F |
Product Overview
2-[(4-Fluorophenyl)methylthio]pyrimidine-4,6-diamine (CAS 340808-48-2), with molecular formula C11H11FN4S and molecular weight 250.07 g/mol. IUPAC: 2-[(4-fluorophenyl)methylsulfanyl]pyrimidine-4,6-diamine.
Chemical Property Profile of 2-[(4-Fluorophenyl)methylthio]pyrimidine-4,6-diamine
Property Insights of 2-[(4-Fluorophenyl)methylthio]pyrimidine-4,6-diamine
The XLogP value of 2.0724 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(4-Fluorophenyl)methylthio]pyrimidine-4,6-diamine. The TPSA of 77.82 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(4-Fluorophenyl)methylthio]pyrimidine-4,6-diamine. Following Lipinski's Rule of Five, 2-[(4-Fluorophenyl)methylthio]pyrimidine-4,6-diamine has 2 hydrogen bond donor(s) and 5 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 2-[(4-Fluorophenyl)methylthio]pyrimidine-4,6-diamine?
The CAS number of 2-[(4-Fluorophenyl)methylthio]pyrimidine-4,6-diamine is 340808-48-2.
What is the molecular formula of 2-[(4-Fluorophenyl)methylthio]pyrimidine-4,6-diamine?
The molecular formula of 2-[(4-Fluorophenyl)methylthio]pyrimidine-4,6-diamine is C11H11FN4S.
What is the molecular weight of 2-[(4-Fluorophenyl)methylthio]pyrimidine-4,6-diamine?
The molecular weight of 2-[(4-Fluorophenyl)methylthio]pyrimidine-4,6-diamine is 250.07 g/mol.
Where can I buy 2-[(4-Fluorophenyl)methylthio]pyrimidine-4,6-diamine?
You can request a quote for 2-[(4-Fluorophenyl)methylthio]pyrimidine-4,6-diamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(4-Fluorophenyl)methylthio]pyrimidine-4,6-diamine?
Yes, KEHONG BIO provides custom synthesis services for 2-[(4-Fluorophenyl)methylthio]pyrimidine-4,6-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.