Pyrimidine, 2-(butylthio)-
TL;DR: Pyrimidine, 2-(butylthio)- (CAS 66348-66-1) is a chemical compound with molecular formula C8H12N2S and molecular weight 168.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-butylsulfanylpyrimidine
Also Known As: 2-butylsulfanylpyrimidine, 2-butylthiopyrimidine, 2-Butylthio-pyrimidin, Pyrimidine, 2-(butylthio)-, 2-(BUTYLSULFANYL)PYRIMIDINE
| Molecular Formula | C8H12N2S |
|---|---|
| Molecular Weight | 168.07 g/mol |
| LogP | 2.3688 |
| Topological Polar Surface Area | 25.78 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 168.07211 |
| Heavy Atoms | 11 |
| Complexity | 188.54337 |
Chemical Identifiers
| CAS Number | 66348-66-1 |
|---|---|
| SMILES | CCCCSC1=NC=CC=N1 |
Product Overview
Pyrimidine, 2-(butylthio)- (CAS 66348-66-1), with molecular formula C8H12N2S and molecular weight 168.07 g/mol. IUPAC: 2-butylsulfanylpyrimidine.
Chemical Property Profile of Pyrimidine, 2-(butylthio)-
Property Insights of Pyrimidine, 2-(butylthio)-
The XLogP value of 2.3688 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyrimidine, 2-(butylthio)-. With a topological polar surface area (TPSA) of 25.78 Ų, Pyrimidine, 2-(butylthio)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyrimidine, 2-(butylthio)- 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 Pyrimidine, 2-(butylthio)-?
The CAS number of Pyrimidine, 2-(butylthio)- is 66348-66-1.
What is the molecular formula of Pyrimidine, 2-(butylthio)-?
The molecular formula of Pyrimidine, 2-(butylthio)- is C8H12N2S.
What is the molecular weight of Pyrimidine, 2-(butylthio)-?
The molecular weight of Pyrimidine, 2-(butylthio)- is 168.07 g/mol.
Where can I buy Pyrimidine, 2-(butylthio)-?
You can request a quote for Pyrimidine, 2-(butylthio)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyrimidine, 2-(butylthio)-?
Yes, KEHONG BIO provides custom synthesis services for Pyrimidine, 2-(butylthio)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.