AC1MKSPY
ethyl 2-[6-(3,5-dimethylphenyl)-4,7-dimethyl-1,3-dioxopurino[7,8-a]imidazol-2-yl]acetate
Also Known As: BAS 12522589|UPCMLD0ENAT5876058:001|ethyl 2-[6-(3,5-dimethylphenyl)-4,7-dimethyl-1,3-dioxopurino[7,8-a]imidazol-2-yl]acetate|ethyl 2-[8-(3,5-dimethylphenyl)-1,7-dimethyl-2,4-dioxo-1,3,5-trihydro-4-imidaz olino[1,2-h]purin-3-yl]acetate|ethyl 2-[8-(3,5-dimethylphenyl)-1,7-dimethyl-2,4-dioxo-1H,2H,3H,4H,8H-imidazo[1,2-g]purin-3-yl]acetate
| Molecular Formula | C21H23N5O4 |
|---|---|
| Molecular Weight | 409.17502 g/mol |
| LogP | 1.62696 |
| Topological Polar Surface Area | 92.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 409.17502 |
| Monoisotopic Mass | 409.17502 |
| Heavy Atoms | 30 |
| Complexity | 1413.876 |
Chemical Identifiers
| CAS Number | 876901-44-9 |
|---|---|
| SMILES | CCOC(=O)CN1C(=O)C2=C(N=C3N2C=C(N3C4=CC(=CC(=C4)C)C)C)N(C1=O)C |
Product Overview
AC1MKSPY (CAS 876901-44-9), with molecular formula C21H23N5O4 and molecular weight 409.17502 g/mol. IUPAC: ethyl 2-[6-(3,5-dimethylphenyl)-4,7-dimethyl-1,3-dioxopurino[7,8-a]imidazol-2-yl]acetate.
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