Ethyl 1-ethyl-6-methyl-2-oxo-4-[4-(2-phenylbutanamido)phenyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate
TL;DR: Ethyl 1-ethyl-6-methyl-2-oxo-4-[4-(2-phenylbutanamido)phenyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate (CAS 5932-95-6) is a chemical compound with molecular formula C26H31N3O4 and molecular weight 449.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-ethyl-4-methyl-2-oxo-6-[4-(2-phenylbutanoylamino)phenyl]-1,6-dihydropyrimidine-5-carboxylate
Also Known As: Ethyl 1-ethyl-6-methyl-2-oxo-4-[4-(2-phenylbutanamido)phenyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate, ethyl 3-ethyl-4-methyl-2-oxo-6-[4-(2-phenylbutanoylamino)phenyl]-1,6-dihydropyrimidine-5-carboxylate
| Molecular Formula | C26H31N3O4 |
|---|---|
| Molecular Weight | 449.23 g/mol |
| LogP | 4.7422 |
| Topological Polar Surface Area | 87.74 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 449.23145 |
| Heavy Atoms | 33 |
| Complexity | 1031.2623 |
Chemical Identifiers
| CAS Number | 5932-95-6 |
|---|---|
| SMILES | CCC(C1=CC=CC=C1)C(=O)NC2=CC=C(C=C2)C3C(=C(N(C(=O)N3)CC)C)C(=O)OCC |
Product Overview
Ethyl 1-ethyl-6-methyl-2-oxo-4-[4-(2-phenylbutanamido)phenyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate (CAS 5932-95-6), with molecular formula C26H31N3O4 and molecular weight 449.23 g/mol. IUPAC: ethyl 3-ethyl-4-methyl-2-oxo-6-[4-(2-phenylbutanoylamino)phenyl]-1,6-dihydropyrimidine-5-carboxylate.
Chemical Property Profile of Ethyl 1-ethyl-6-methyl-2-oxo-4-[4-(2-phenylbutanamido)phenyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Property Insights of Ethyl 1-ethyl-6-methyl-2-oxo-4-[4-(2-phenylbutanamido)phenyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate
The XLogP value of 4.7422 indicates that Ethyl 1-ethyl-6-methyl-2-oxo-4-[4-(2-phenylbutanamido)phenyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.74 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 1-ethyl-6-methyl-2-oxo-4-[4-(2-phenylbutanamido)phenyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate. Following Lipinski's Rule of Five, Ethyl 1-ethyl-6-methyl-2-oxo-4-[4-(2-phenylbutanamido)phenyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate has 2 hydrogen bond donor(s) and 4 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 1-ethyl-6-methyl-2-oxo-4-[4-(2-phenylbutanamido)phenyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate?
The CAS number of Ethyl 1-ethyl-6-methyl-2-oxo-4-[4-(2-phenylbutanamido)phenyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate is 5932-95-6.
What is the molecular formula of Ethyl 1-ethyl-6-methyl-2-oxo-4-[4-(2-phenylbutanamido)phenyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate?
The molecular formula of Ethyl 1-ethyl-6-methyl-2-oxo-4-[4-(2-phenylbutanamido)phenyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate is C26H31N3O4.
What is the molecular weight of Ethyl 1-ethyl-6-methyl-2-oxo-4-[4-(2-phenylbutanamido)phenyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate?
The molecular weight of Ethyl 1-ethyl-6-methyl-2-oxo-4-[4-(2-phenylbutanamido)phenyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate is 449.23 g/mol.
Where can I buy Ethyl 1-ethyl-6-methyl-2-oxo-4-[4-(2-phenylbutanamido)phenyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate?
You can request a quote for Ethyl 1-ethyl-6-methyl-2-oxo-4-[4-(2-phenylbutanamido)phenyl]-1,2,3,4-tetrahydropyrimidine-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 1-ethyl-6-methyl-2-oxo-4-[4-(2-phenylbutanamido)phenyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 1-ethyl-6-methyl-2-oxo-4-[4-(2-phenylbutanamido)phenyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.