5-Phenyl-2-(2-propynylsulfanyl)pyrimidine
TL;DR: 5-Phenyl-2-(2-propynylsulfanyl)pyrimidine (CAS 344282-03-7) is a chemical compound with molecular formula C13H10N2S and molecular weight 226.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-phenyl-2-prop-2-ynylsulfanylpyrimidine
Also Known As: 5-phenyl-2-(2-propynylsulfanyl)pyrimidine, 5-phenyl-2-(prop-2-yn-1-ylsulfanyl)pyrimidine, 5-phenyl-2-prop-2-ynylsulfanylpyrimidine, 5-phenyl-2-prop-2-ynylsulfanyl-pyrimidine, 5-phenyl-2-(propargylthio)pyrimidine
| Molecular Formula | C13H10N2S |
|---|---|
| Molecular Weight | 226.06 g/mol |
| LogP | 2.8689 |
| Topological Polar Surface Area | 25.78 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 226.05647 |
| Heavy Atoms | 16 |
| Complexity | 485.5911 |
Chemical Identifiers
| CAS Number | 344282-03-7 |
|---|---|
| SMILES | C#CCSC1=NC=C(C=N1)C2=CC=CC=C2 |
Product Overview
5-Phenyl-2-(2-propynylsulfanyl)pyrimidine (CAS 344282-03-7), with molecular formula C13H10N2S and molecular weight 226.06 g/mol. IUPAC: 5-phenyl-2-prop-2-ynylsulfanylpyrimidine.
Chemical Property Profile of 5-Phenyl-2-(2-propynylsulfanyl)pyrimidine
Property Insights of 5-Phenyl-2-(2-propynylsulfanyl)pyrimidine
The XLogP value of 2.8689 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Phenyl-2-(2-propynylsulfanyl)pyrimidine. With a topological polar surface area (TPSA) of 25.78 Ų, 5-Phenyl-2-(2-propynylsulfanyl)pyrimidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Phenyl-2-(2-propynylsulfanyl)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 5-Phenyl-2-(2-propynylsulfanyl)pyrimidine?
The CAS number of 5-Phenyl-2-(2-propynylsulfanyl)pyrimidine is 344282-03-7.
What is the molecular formula of 5-Phenyl-2-(2-propynylsulfanyl)pyrimidine?
The molecular formula of 5-Phenyl-2-(2-propynylsulfanyl)pyrimidine is C13H10N2S.
What is the molecular weight of 5-Phenyl-2-(2-propynylsulfanyl)pyrimidine?
The molecular weight of 5-Phenyl-2-(2-propynylsulfanyl)pyrimidine is 226.06 g/mol.
Where can I buy 5-Phenyl-2-(2-propynylsulfanyl)pyrimidine?
You can request a quote for 5-Phenyl-2-(2-propynylsulfanyl)pyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Phenyl-2-(2-propynylsulfanyl)pyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 5-Phenyl-2-(2-propynylsulfanyl)pyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.