Ethyl 2,4-dihydroxy-7-(4-(hydroxy(oxido)amino)phenyl)-6,7-dihydro-5H-pyrano(2,3-d)pyrimidine-6-carboxylate
TL;DR: Ethyl 2,4-dihydroxy-7-(4-(hydroxy(oxido)amino)phenyl)-6,7-dihydro-5H-pyrano(2,3-d)pyrimidine-6-carboxylate (CAS 69310-75-4) is a chemical compound with molecular formula C16H15N3O7 and molecular weight 361.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 7-(4-nitrophenyl)-2,4-dioxo-1,5,6,7-tetrahydropyrano[2,3-d]pyrimidine-6-carboxylate
Also Known As: Ethyl 2,4-dihydroxy-7-(4-(hydroxy(oxido)amino)phenyl)-6,7-dihydro-5H-pyrano(2,3-d)pyrimidine-6-carboxylate, ethyl 2,4-dihydroxy-7-(4-nitrophenyl)-6,7-dihydro-5H-pyrano[2,3-d]pyrimidine-6-carboxylate, ethyl 7-(4-nitrophenyl)-2,4-dioxo-1,5,6,7-tetrahydropyrano[2, ethyl 7-(4-nitrophenyl)-2,4-dioxo-1,5,6,7-tetrahydropyrano[2,3-d]pyrimidine-6-carboxylate, 2H-Pyrano[2,3-d]pyrimidine-6-carboxylicacid, 1,3,4,5,6,7-hexahydro-7-(4-nitrophenyl)-2,4-dioxo-, ethyl ester
| Molecular Formula | C16H15N3O7 |
|---|---|
| Molecular Weight | 361.09 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 140.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 361.091 |
| Heavy Atoms | 26 |
| Complexity | 661.0 |
Chemical Identifiers
| CAS Number | 69310-75-4 |
|---|---|
| SMILES | CCOC(=O)C1CC2=C(NC(=O)NC2=O)OC1C3=CC=C(C=C3)[N+](=O)[O-] |
| InChIKey | FQCZDYNWLAHGCW-UHFFFAOYSA-N |
Product Overview
Ethyl 2,4-dihydroxy-7-(4-(hydroxy(oxido)amino)phenyl)-6,7-dihydro-5H-pyrano(2,3-d)pyrimidine-6-carboxylate (CAS 69310-75-4), with molecular formula C16H15N3O7 and molecular weight 361.09 g/mol. IUPAC: ethyl 7-(4-nitrophenyl)-2,4-dioxo-1,5,6,7-tetrahydropyrano[2,3-d]pyrimidine-6-carboxylate.
Chemical Property Profile of Ethyl 2,4-dihydroxy-7-(4-(hydroxy(oxido)amino)phenyl)-6,7-dihydro-5H-pyrano(2,3-d)pyrimidine-6-carboxylate
Property Insights of Ethyl 2,4-dihydroxy-7-(4-(hydroxy(oxido)amino)phenyl)-6,7-dihydro-5H-pyrano(2,3-d)pyrimidine-6-carboxylate
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2,4-dihydroxy-7-(4-(hydroxy(oxido)amino)phenyl)-6,7-dihydro-5H-pyrano(2,3-d)pyrimidine-6-carboxylate. The TPSA of 140.0 Ų indicates high polarity, suggesting Ethyl 2,4-dihydroxy-7-(4-(hydroxy(oxido)amino)phenyl)-6,7-dihydro-5H-pyrano(2,3-d)pyrimidine-6-carboxylate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Ethyl 2,4-dihydroxy-7-(4-(hydroxy(oxido)amino)phenyl)-6,7-dihydro-5H-pyrano(2,3-d)pyrimidine-6-carboxylate has 2 hydrogen bond donor(s) and 7 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 2,4-dihydroxy-7-(4-(hydroxy(oxido)amino)phenyl)-6,7-dihydro-5H-pyrano(2,3-d)pyrimidine-6-carboxylate?
The CAS number of Ethyl 2,4-dihydroxy-7-(4-(hydroxy(oxido)amino)phenyl)-6,7-dihydro-5H-pyrano(2,3-d)pyrimidine-6-carboxylate is 69310-75-4.
What is the molecular formula of Ethyl 2,4-dihydroxy-7-(4-(hydroxy(oxido)amino)phenyl)-6,7-dihydro-5H-pyrano(2,3-d)pyrimidine-6-carboxylate?
The molecular formula of Ethyl 2,4-dihydroxy-7-(4-(hydroxy(oxido)amino)phenyl)-6,7-dihydro-5H-pyrano(2,3-d)pyrimidine-6-carboxylate is C16H15N3O7.
What is the molecular weight of Ethyl 2,4-dihydroxy-7-(4-(hydroxy(oxido)amino)phenyl)-6,7-dihydro-5H-pyrano(2,3-d)pyrimidine-6-carboxylate?
The molecular weight of Ethyl 2,4-dihydroxy-7-(4-(hydroxy(oxido)amino)phenyl)-6,7-dihydro-5H-pyrano(2,3-d)pyrimidine-6-carboxylate is 361.09 g/mol.
Where can I buy Ethyl 2,4-dihydroxy-7-(4-(hydroxy(oxido)amino)phenyl)-6,7-dihydro-5H-pyrano(2,3-d)pyrimidine-6-carboxylate?
You can request a quote for Ethyl 2,4-dihydroxy-7-(4-(hydroxy(oxido)amino)phenyl)-6,7-dihydro-5H-pyrano(2,3-d)pyrimidine-6-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2,4-dihydroxy-7-(4-(hydroxy(oxido)amino)phenyl)-6,7-dihydro-5H-pyrano(2,3-d)pyrimidine-6-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2,4-dihydroxy-7-(4-(hydroxy(oxido)amino)phenyl)-6,7-dihydro-5H-pyrano(2,3-d)pyrimidine-6-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.