AC1NKYU0
6-(4-bromophenyl)-2-(3-hydroxypropyl)-4,7-dimethylpurino[7,8-a]imidazole-1,3-dione
Also Known As: 8-(4-bromophenyl)-3-(3-hydroxypropyl)-1,7-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione|6-(4-bromophenyl)-2-(3-hydroxypropyl)-4,7-dimethylpurino[7,8-a]imidazole-1,3-dione|8-(4-bromophenyl)-3-(3-hydroxypropyl)-1,7-dimethyl-1,3,5-trihydro-4-imidazolin o[1,2-h]purine-2,4-dione
CAS: 899404-20-7
| Molecular Formula | C18H18BrN5O3 |
|---|---|
| Molecular Weight | 431.0593 g/mol |
| LogP | 1.59192 |
| Topological Polar Surface Area | 86.46 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 431.0593 |
| Monoisotopic Mass | 431.0593 |
| Heavy Atoms | 27 |
| Complexity | 1277.2908 |
Chemical Identifiers
| CAS Number | 899404-20-7 |
|---|---|
| SMILES | CC1=CN2C3=C(N=C2N1C4=CC=C(C=C4)Br)N(C(=O)N(C3=O)CCCO)C |
Product Overview
AC1NKYU0 (CAS 899404-20-7), with molecular formula C18H18BrN5O3 and molecular weight 431.0593 g/mol. IUPAC: 6-(4-bromophenyl)-2-(3-hydroxypropyl)-4,7-dimethylpurino[7,8-a]imidazole-1,3-dione.
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.
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