ethyl 4-[(6-hydroxy-2,4-dioxo-1H-pyrimidine-5-carbonyl)amino]benzoate
ethyl 4-[(6-hydroxy-2,4-dioxo-1H-pyrimidine-5-carbonyl)amino]benzoate
Also Known As: CC-PMLSC-PW-kmc1048|ethyl 4-[(6-hydroxy-2,4-dioxo-1H-pyrimidine-5-carbonyl)amino]benzoate|ethyl 4-(6-hydroxy-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carboxamido)benzoate|4-[(6-hydroxy-2,4-diketo-1H-pyrimidine-5-carbonyl)amino]benzoic acid ethyl ester|4-[[(6-hydroxy-2,4-dioxo-1H-pyrimidin-5-yl)-oxomethyl]amino]benzoic acid ethyl ester|ethyl 4-[[6-oxidanyl-2,4-bis(oxidanylidene)-1H-pyrimidin-5-yl]carbonylamino]benzoate|ethyl 4-{[(4,6-dihydroxy-2-oxo-1,2-dihydropyrimidin-5-yl)carbonyl]amino}benzoate
| Molecular Formula | C14H13N3O6 |
|---|---|
| Molecular Weight | 319.08044 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 134.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 319.08044 |
| Monoisotopic Mass | 319.08044 |
| Heavy Atoms | 23 |
| Complexity | 563.0 |
Chemical Identifiers
| CAS Number | 577985-53-6 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C(NC(=O)NC2=O)O |
| InChIKey | XWZUFKMEGYKBSH-UHFFFAOYSA-N |
Product Overview
ethyl 4-[(6-hydroxy-2,4-dioxo-1H-pyrimidine-5-carbonyl)amino]benzoate (CAS 577985-53-6), with molecular formula C14H13N3O6 and molecular weight 319.08044 g/mol. IUPAC: ethyl 4-[(6-hydroxy-2,4-dioxo-1H-pyrimidine-5-carbonyl)amino]benzoate.