Ethyl 2-hydroxy-4-methyl-6-(2-nitrophenyl)-1,6-dihydro-5-pyrimidinecarboxylate
TL;DR: Ethyl 2-hydroxy-4-methyl-6-(2-nitrophenyl)-1,6-dihydro-5-pyrimidinecarboxylate (CAS 17994-61-5) is a chemical compound with molecular formula C14H15N3O5 and molecular weight 305.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 6-methyl-4-(2-nitrophenyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
Also Known As: ethyl 1,2,3,4-tetrahydro-6-methyl-2-oxopyrimidine-5-carboxylate, ethyl 6-methyl-4-(2-nitrophenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate, ethyl 2-hydroxy-4-methyl-6-(2-nitrophenyl)-1,6-dihydro-5-pyrimidinecarboxylate, ethyl 6-methyl-4-(2-nitrophenyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate, 1,2,3,4-Tetrahydro-4-(2-nitrophenyl)-6-methyl-2-oxopyrimidine-5-carboxylic acid ethyl ester
| Molecular Formula | C14H15N3O5 |
|---|---|
| Molecular Weight | 305.10 g/mol |
| LogP | 1.7858 |
| Topological Polar Surface Area | 110.57 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 305.10117 |
| Heavy Atoms | 22 |
| Complexity | 668.1971 |
Chemical Identifiers
| CAS Number | 17994-61-5 |
|---|---|
| SMILES | CCOC(=O)C1=C(NC(=O)NC1C2=CC=CC=C2[N+](=O)[O-])C |
Product Overview
Ethyl 2-hydroxy-4-methyl-6-(2-nitrophenyl)-1,6-dihydro-5-pyrimidinecarboxylate (CAS 17994-61-5), with molecular formula C14H15N3O5 and molecular weight 305.10 g/mol. IUPAC: ethyl 6-methyl-4-(2-nitrophenyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate.
Chemical Property Profile of Ethyl 2-hydroxy-4-methyl-6-(2-nitrophenyl)-1,6-dihydro-5-pyrimidinecarboxylate
Property Insights of Ethyl 2-hydroxy-4-methyl-6-(2-nitrophenyl)-1,6-dihydro-5-pyrimidinecarboxylate
The XLogP value of 1.7858 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-hydroxy-4-methyl-6-(2-nitrophenyl)-1,6-dihydro-5-pyrimidinecarboxylate. The TPSA of 110.57 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-hydroxy-4-methyl-6-(2-nitrophenyl)-1,6-dihydro-5-pyrimidinecarboxylate. Following Lipinski's Rule of Five, Ethyl 2-hydroxy-4-methyl-6-(2-nitrophenyl)-1,6-dihydro-5-pyrimidinecarboxylate has 2 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 2-hydroxy-4-methyl-6-(2-nitrophenyl)-1,6-dihydro-5-pyrimidinecarboxylate?
The CAS number of Ethyl 2-hydroxy-4-methyl-6-(2-nitrophenyl)-1,6-dihydro-5-pyrimidinecarboxylate is 17994-61-5.
What is the molecular formula of Ethyl 2-hydroxy-4-methyl-6-(2-nitrophenyl)-1,6-dihydro-5-pyrimidinecarboxylate?
The molecular formula of Ethyl 2-hydroxy-4-methyl-6-(2-nitrophenyl)-1,6-dihydro-5-pyrimidinecarboxylate is C14H15N3O5.
What is the molecular weight of Ethyl 2-hydroxy-4-methyl-6-(2-nitrophenyl)-1,6-dihydro-5-pyrimidinecarboxylate?
The molecular weight of Ethyl 2-hydroxy-4-methyl-6-(2-nitrophenyl)-1,6-dihydro-5-pyrimidinecarboxylate is 305.10 g/mol.
Where can I buy Ethyl 2-hydroxy-4-methyl-6-(2-nitrophenyl)-1,6-dihydro-5-pyrimidinecarboxylate?
You can request a quote for Ethyl 2-hydroxy-4-methyl-6-(2-nitrophenyl)-1,6-dihydro-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 2-hydroxy-4-methyl-6-(2-nitrophenyl)-1,6-dihydro-5-pyrimidinecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-hydroxy-4-methyl-6-(2-nitrophenyl)-1,6-dihydro-5-pyrimidinecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.