![Ethyl 4-[(2-amino-2-oxoethyl)sulfanyl]-6-methyl-2-phenylpyrimidine-5-carboxylate structure](/static/products/903/903198-79-8.png)
Ethyl 4-[(2-amino-2-oxoethyl)sulfanyl]-6-methyl-2-phenylpyrimidine-5-carboxylate
TL;DR: Ethyl 4-[(2-amino-2-oxoethyl)sulfanyl]-6-methyl-2-phenylpyrimidine-5-carboxylate (CAS 903198-79-8) is a chemical compound with molecular formula C16H17N3O3S and molecular weight 331.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(2-amino-2-oxoethyl)sulfanyl-6-methyl-2-phenylpyrimidine-5-carboxylate
Also Known As: ethyl 4-((2-amino-2-oxoethyl)thio)-6-methyl-2-phenylpyrimidine-5-carboxylate, ethyl 4-(2-amino-2-oxoethyl)sulfanyl-6-methyl-2-phenylpyrimidine-5-carboxylate, ethyl 4-[(2-amino-2-oxoethyl)sulfanyl]-6-methyl-2-phenylpyrimidine-5-carboxylate
| Molecular Formula | C16H17N3O3S |
|---|---|
| Molecular Weight | 331.10 g/mol |
| LogP | 2.20612 |
| Topological Polar Surface Area | 95.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 331.09906 |
| Heavy Atoms | 23 |
| Complexity | 720.01044 |
Chemical Identifiers
| CAS Number | 903198-79-8 |
|---|---|
| SMILES | CCOC(=O)C1=C(N=C(N=C1SCC(=O)N)C2=CC=CC=C2)C |
Product Overview
Ethyl 4-[(2-amino-2-oxoethyl)sulfanyl]-6-methyl-2-phenylpyrimidine-5-carboxylate (CAS 903198-79-8), with molecular formula C16H17N3O3S and molecular weight 331.10 g/mol. IUPAC: ethyl 4-(2-amino-2-oxoethyl)sulfanyl-6-methyl-2-phenylpyrimidine-5-carboxylate.
Chemical Property Profile of Ethyl 4-[(2-amino-2-oxoethyl)sulfanyl]-6-methyl-2-phenylpyrimidine-5-carboxylate
Property Insights of Ethyl 4-[(2-amino-2-oxoethyl)sulfanyl]-6-methyl-2-phenylpyrimidine-5-carboxylate
The XLogP value of 2.20612 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 4-[(2-amino-2-oxoethyl)sulfanyl]-6-methyl-2-phenylpyrimidine-5-carboxylate. The TPSA of 95.17 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 4-[(2-amino-2-oxoethyl)sulfanyl]-6-methyl-2-phenylpyrimidine-5-carboxylate. Following Lipinski's Rule of Five, Ethyl 4-[(2-amino-2-oxoethyl)sulfanyl]-6-methyl-2-phenylpyrimidine-5-carboxylate has 1 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 Ethyl 4-[(2-amino-2-oxoethyl)sulfanyl]-6-methyl-2-phenylpyrimidine-5-carboxylate?
The CAS number of Ethyl 4-[(2-amino-2-oxoethyl)sulfanyl]-6-methyl-2-phenylpyrimidine-5-carboxylate is 903198-79-8.
What is the molecular formula of Ethyl 4-[(2-amino-2-oxoethyl)sulfanyl]-6-methyl-2-phenylpyrimidine-5-carboxylate?
The molecular formula of Ethyl 4-[(2-amino-2-oxoethyl)sulfanyl]-6-methyl-2-phenylpyrimidine-5-carboxylate is C16H17N3O3S.
What is the molecular weight of Ethyl 4-[(2-amino-2-oxoethyl)sulfanyl]-6-methyl-2-phenylpyrimidine-5-carboxylate?
The molecular weight of Ethyl 4-[(2-amino-2-oxoethyl)sulfanyl]-6-methyl-2-phenylpyrimidine-5-carboxylate is 331.10 g/mol.
Where can I buy Ethyl 4-[(2-amino-2-oxoethyl)sulfanyl]-6-methyl-2-phenylpyrimidine-5-carboxylate?
You can request a quote for Ethyl 4-[(2-amino-2-oxoethyl)sulfanyl]-6-methyl-2-phenylpyrimidine-5-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 4-[(2-amino-2-oxoethyl)sulfanyl]-6-methyl-2-phenylpyrimidine-5-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-[(2-amino-2-oxoethyl)sulfanyl]-6-methyl-2-phenylpyrimidine-5-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.