Phenacyl 2-methylsulfanylpyrimidine-5-carboxylate
TL;DR: Phenacyl 2-methylsulfanylpyrimidine-5-carboxylate (CAS 1024147-10-1) is a chemical compound with molecular formula C14H12N2O3S and molecular weight 288.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
phenacyl 2-methylsulfanylpyrimidine-5-carboxylate
Also Known As: Phenacyl 2-methylsulfanylpyrimidine-5-carboxylate
| Molecular Formula | C14H12N2O3S |
|---|---|
| Molecular Weight | 288.06 g/mol |
| LogP | 2.2382 |
| Topological Polar Surface Area | 69.15 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 288.05685 |
| Heavy Atoms | 20 |
| Complexity | 599.5759 |
Chemical Identifiers
| CAS Number | 1024147-10-1 |
|---|---|
| SMILES | CSC1=NC=C(C=N1)C(=O)OCC(=O)C2=CC=CC=C2 |
Product Overview
Phenacyl 2-methylsulfanylpyrimidine-5-carboxylate (CAS 1024147-10-1), with molecular formula C14H12N2O3S and molecular weight 288.06 g/mol. IUPAC: phenacyl 2-methylsulfanylpyrimidine-5-carboxylate.
Chemical Property Profile of Phenacyl 2-methylsulfanylpyrimidine-5-carboxylate
Property Insights of Phenacyl 2-methylsulfanylpyrimidine-5-carboxylate
The XLogP value of 2.2382 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phenacyl 2-methylsulfanylpyrimidine-5-carboxylate. The TPSA of 69.15 Ų falls within the moderate polarity range, balancing permeability and solubility for Phenacyl 2-methylsulfanylpyrimidine-5-carboxylate. Following Lipinski's Rule of Five, Phenacyl 2-methylsulfanylpyrimidine-5-carboxylate has 0 hydrogen bond donor(s) and 6 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 Phenacyl 2-methylsulfanylpyrimidine-5-carboxylate?
The CAS number of Phenacyl 2-methylsulfanylpyrimidine-5-carboxylate is 1024147-10-1.
What is the molecular formula of Phenacyl 2-methylsulfanylpyrimidine-5-carboxylate?
The molecular formula of Phenacyl 2-methylsulfanylpyrimidine-5-carboxylate is C14H12N2O3S.
What is the molecular weight of Phenacyl 2-methylsulfanylpyrimidine-5-carboxylate?
The molecular weight of Phenacyl 2-methylsulfanylpyrimidine-5-carboxylate is 288.06 g/mol.
Where can I buy Phenacyl 2-methylsulfanylpyrimidine-5-carboxylate?
You can request a quote for Phenacyl 2-methylsulfanylpyrimidine-5-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenacyl 2-methylsulfanylpyrimidine-5-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Phenacyl 2-methylsulfanylpyrimidine-5-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.