Ethyl 4-(benzoylamino)-2,6-dimethyl-5-pyrimidinecarboxylate
TL;DR: Ethyl 4-(benzoylamino)-2,6-dimethyl-5-pyrimidinecarboxylate (CAS 353784-72-2) is a chemical compound with molecular formula C16H17N3O3 and molecular weight 299.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-benzamido-2,6-dimethylpyrimidine-5-carboxylate
Also Known As: BIM-0048261.P001, ethyl 4-benzamido-2,6-dimethylpyrimidine-5-carboxylate, ethyl 4-(benzoylamino)-2,6-dimethyl-5-pyrimidinecarboxylate
| Molecular Formula | C16H17N3O3 |
|---|---|
| Molecular Weight | 299.13 g/mol |
| LogP | 2.52244 |
| Topological Polar Surface Area | 81.18 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 299.12698 |
| Heavy Atoms | 22 |
| Complexity | 699.2823 |
Chemical Identifiers
| CAS Number | 353784-72-2 |
|---|---|
| SMILES | CCOC(=O)C1=C(N=C(N=C1NC(=O)C2=CC=CC=C2)C)C |
Product Overview
Ethyl 4-(benzoylamino)-2,6-dimethyl-5-pyrimidinecarboxylate (CAS 353784-72-2), with molecular formula C16H17N3O3 and molecular weight 299.13 g/mol. IUPAC: ethyl 4-benzamido-2,6-dimethylpyrimidine-5-carboxylate.
Chemical Property Profile of Ethyl 4-(benzoylamino)-2,6-dimethyl-5-pyrimidinecarboxylate
Property Insights of Ethyl 4-(benzoylamino)-2,6-dimethyl-5-pyrimidinecarboxylate
The XLogP value of 2.52244 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 4-(benzoylamino)-2,6-dimethyl-5-pyrimidinecarboxylate. The TPSA of 81.18 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 4-(benzoylamino)-2,6-dimethyl-5-pyrimidinecarboxylate. Following Lipinski's Rule of Five, Ethyl 4-(benzoylamino)-2,6-dimethyl-5-pyrimidinecarboxylate 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-(benzoylamino)-2,6-dimethyl-5-pyrimidinecarboxylate?
The CAS number of Ethyl 4-(benzoylamino)-2,6-dimethyl-5-pyrimidinecarboxylate is 353784-72-2.
What is the molecular formula of Ethyl 4-(benzoylamino)-2,6-dimethyl-5-pyrimidinecarboxylate?
The molecular formula of Ethyl 4-(benzoylamino)-2,6-dimethyl-5-pyrimidinecarboxylate is C16H17N3O3.
What is the molecular weight of Ethyl 4-(benzoylamino)-2,6-dimethyl-5-pyrimidinecarboxylate?
The molecular weight of Ethyl 4-(benzoylamino)-2,6-dimethyl-5-pyrimidinecarboxylate is 299.13 g/mol.
Where can I buy Ethyl 4-(benzoylamino)-2,6-dimethyl-5-pyrimidinecarboxylate?
You can request a quote for Ethyl 4-(benzoylamino)-2,6-dimethyl-5-pyrimidinecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 4-(benzoylamino)-2,6-dimethyl-5-pyrimidinecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-(benzoylamino)-2,6-dimethyl-5-pyrimidinecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.