AC1MKTU0
2-[(2-fluorophenyl)methyl]-6-(3-methoxypropyl)-4,7,8-trimethylpurino[7,8-a]imidazole-1,3-dione
Also Known As: BAS 12663333|UPCMLD0ENAT5815256:001|2-[(2-fluorophenyl)methyl]-6-(3-methoxypropyl)-4,7,8-trimethylpurino[7,8-a]imidazole-1,3-dione|3-[(2-fluorophenyl)methyl]-8-(3-methoxypropyl)-1,6,7-trimethyl-1H,2H,3H,4H,8H-imidazo[1,2-g]purine-2,4-dione|3-[(2-fluorophenyl)methyl]-8-(3-methoxypropyl)-1,6,7-trimethyl-1,3,5-trihydro- 4-imidazolino[1,2-h]purine-2,4-dione|3-[(2-Fluorophenyl)methyl]-8-(3-methoxypropyl)-1,6,7-trimethyl-1,3,5-trihydro-4-imidazolino[1,2-h]purine-2,4-dione
| Molecular Formula | C21H24FN5O3 |
|---|---|
| Molecular Weight | 413.1863 g/mol |
| LogP | 1.99014 |
| Topological Polar Surface Area | 75.46 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 413.1863 |
| Monoisotopic Mass | 413.1863 |
| Heavy Atoms | 30 |
| Complexity | 1375.791 |
Chemical Identifiers
| CAS Number | 876675-53-5 |
|---|---|
| SMILES | CC1=C(N2C3=C(N=C2N1CCCOC)N(C(=O)N(C3=O)CC4=CC=CC=C4F)C)C |
Product Overview
AC1MKTU0 (CAS 876675-53-5), with molecular formula C21H24FN5O3 and molecular weight 413.1863 g/mol. IUPAC: 2-[(2-fluorophenyl)methyl]-6-(3-methoxypropyl)-4,7,8-trimethylpurino[7,8-a]imidazole-1,3-dione.
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