Ethyl 4-amino-2-phenylpyrimidine-5-carboxylate
TL;DR: Ethyl 4-amino-2-phenylpyrimidine-5-carboxylate (CAS 5362-53-8) is a chemical compound with molecular formula C13H13N3O2 and molecular weight 243.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-amino-2-phenylpyrimidine-5-carboxylate
Also Known As: ethyl 4-amino-2-phenylpyrimidine-5-carboxylate, ethyl4-amino-2-phenylpyrimidine-5-carboxylate, 4-amino-2-phenyl-pyrimidine-5-carboxylic acid ethyl ester, ethyl 4-amino-2-phenyl-5-pyrimidinecarboxylate, 2-Phenyl-4-aminopyrimidine-5-carboxylic acid ethyl ester
| Molecular Formula | C13H13N3O2 |
|---|---|
| Molecular Weight | 243.10 g/mol |
| LogP | 1.9025 |
| Topological Polar Surface Area | 78.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 243.10077 |
| Heavy Atoms | 18 |
| Complexity | 555.4177 |
Chemical Identifiers
| CAS Number | 5362-53-8 |
|---|---|
| SMILES | CCOC(=O)C1=CN=C(N=C1N)C2=CC=CC=C2 |
Product Overview
Ethyl 4-amino-2-phenylpyrimidine-5-carboxylate (CAS 5362-53-8), with molecular formula C13H13N3O2 and molecular weight 243.10 g/mol. IUPAC: ethyl 4-amino-2-phenylpyrimidine-5-carboxylate.
Chemical Property Profile of Ethyl 4-amino-2-phenylpyrimidine-5-carboxylate
Property Insights of Ethyl 4-amino-2-phenylpyrimidine-5-carboxylate
The XLogP value of 1.9025 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 4-amino-2-phenylpyrimidine-5-carboxylate. The TPSA of 78.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 4-amino-2-phenylpyrimidine-5-carboxylate. Following Lipinski's Rule of Five, Ethyl 4-amino-2-phenylpyrimidine-5-carboxylate has 1 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 Ethyl 4-amino-2-phenylpyrimidine-5-carboxylate?
The CAS number of Ethyl 4-amino-2-phenylpyrimidine-5-carboxylate is 5362-53-8.
What is the molecular formula of Ethyl 4-amino-2-phenylpyrimidine-5-carboxylate?
The molecular formula of Ethyl 4-amino-2-phenylpyrimidine-5-carboxylate is C13H13N3O2.
What is the molecular weight of Ethyl 4-amino-2-phenylpyrimidine-5-carboxylate?
The molecular weight of Ethyl 4-amino-2-phenylpyrimidine-5-carboxylate is 243.10 g/mol.
Where can I buy Ethyl 4-amino-2-phenylpyrimidine-5-carboxylate?
You can request a quote for Ethyl 4-amino-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-amino-2-phenylpyrimidine-5-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-amino-2-phenylpyrimidine-5-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.