AC1LNTQB
8-(4-bromophenoxy)-1,3-dimethyl-7-[[3-(trifluoromethyl)phenyl]methyl]purine-2,6-dione
Also Known As: AN-512/12594128|8-(4-bromophenoxy)-1,3-dimethyl-7-[3-(trifluoromethyl)benzyl]-3,7-dihydro-1H-purine-2,6-dione|8-(4-bromophenoxy)-1,3-dimethyl-7-[[3-(trifluoromethyl)phenyl]methyl]purine-2,6-dione|8-(4-bromophenoxy)-1,3-dimethyl-7-(3-(trifluoromethyl)benzyl)-1H-purine-2,6(3H,7H)-dione|8-(4-BROMOPHENOXY)-1,3-DIMETHYL-7-{[3-(TRIFLUOROMETHYL)PHENYL]METHYL}-2,3,6,7-TETRAHYDRO-1H-PURINE-2,6-DIONE
CAS: 317841-48-8
| Molecular Formula | C21H16BrF3N4O3 |
|---|---|
| Molecular Weight | 508.0358 g/mol |
| LogP | 4.0556 |
| Topological Polar Surface Area | 71.05 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 508.0358 |
| Monoisotopic Mass | 508.0358 |
| Heavy Atoms | 32 |
| Complexity | 1436.4254 |
Chemical Identifiers
| CAS Number | 317841-48-8 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)OC3=CC=C(C=C3)Br)CC4=CC(=CC=C4)C(F)(F)F |
Product Overview
AC1LNTQB (CAS 317841-48-8), with molecular formula C21H16BrF3N4O3 and molecular weight 508.0358 g/mol. IUPAC: 8-(4-bromophenoxy)-1,3-dimethyl-7-[[3-(trifluoromethyl)phenyl]methyl]purine-2,6-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.
View MSDS →
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