AC1NKLPE
ethyl 4-(4,7-dimethyl-1,3-dioxopurino[7,8-a]imidazol-6-yl)benzoate
Also Known As: VU0606772-1|F3235-1330|ethyl 4-(4,7-dimethyl-1,3-dioxopurino[7,8-a]imidazol-6-yl)benzoate|ethyl 4-(1,7-dimethyl-2,4-dioxo-1,3,5-trihydro-4-imidazolino[1,2-h]purin-8-yl) benzoate|ethyl 4-(1,7-dimethyl-2,4-dioxo-3,4-dihydro-1H-imidazo[2,1-f]purin-8(2H)-yl)benzoate|ethyl 4-(4-hydroxy-1,7-dimethyl-2-oxo-1,2-dihydro-8H-imidazo[2,1-f]purin-8-yl)benzoate|ethyl 4-{1,7-dimethyl-2,4-dioxo-1H,2H,3H,4H,8H-imidazo[1,2-g]purin-8-yl}benzoate
CAS: 879446-10-3
| Molecular Formula | C18H17N5O4 |
|---|---|
| Molecular Weight | 367.12805 g/mol |
| LogP | 1.15032 |
| Topological Polar Surface Area | 103.39 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 367.12805 |
| Monoisotopic Mass | 367.12805 |
| Heavy Atoms | 27 |
| Complexity | 1304.261 |
Chemical Identifiers
| CAS Number | 879446-10-3 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)N2C(=CN3C2=NC4=C3C(=O)NC(=O)N4C)C |
Product Overview
AC1NKLPE (CAS 879446-10-3), with molecular formula C18H17N5O4 and molecular weight 367.12805 g/mol. IUPAC: ethyl 4-(4,7-dimethyl-1,3-dioxopurino[7,8-a]imidazol-6-yl)benzoate.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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