AC1LD7FN
3-(4-fluorophenyl)-1-(2-hydroxyethyl)-7,9-dimethyl-4H-purino[8,7-c][1,2,4]triazine-6,8-dione
Also Known As: SR-01000538079-1|A2777/0117545|3-(4-Fluorophenyl)-1-(2-hydroxyethyl)-7,9-dimethyl-1,4-dihydro[1,2,4]triazino[3,4-f]purine-6,8(7H,9H)-dione|3-(4-Fluoro-phenyl)-1-(2-hydroxy-ethyl)-6,8-dimethyl-1,4-dihydro-8H-1,2,4a,6,8,9-hexaaza-fluorene-5,7-dione|3-(4-Fluorophenyl)-1-(2-hydroxyethyl)-7,9-dimethyl-1,4-dihydro[1,2,4]triazino[3,4-f]purine-6,8(7H,9H)-dione #|3-(4-FLUOROPHENYL)-1-(2-HYDROXYETHYL)-7,9-DIMETHYL-1H,4H,6H,7H,8H,9H-[1,2,4]TRIAZINO[4,3-G]PURINE-6,8-DIONE|3-(4-fluorophenyl)-1-(2-hydroxyethyl)-7,9-dimethyl-4H-purino[8,7-c][1,2,4]triazine-6,8-dione|3-(4-fluorophenyl)-1-(2-hydroxyethyl)-7,9-dimethyl-7,9-dihydro-[1,2,4]triazino[3,4-f]purine-6,8(1H,4H)-dione
| Molecular Formula | C17H17FN6O3 |
|---|---|
| Molecular Weight | 372.1346 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 94.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 372.1346 |
| Monoisotopic Mass | 372.1346 |
| Heavy Atoms | 27 |
| Complexity | 653.0 |
Chemical Identifiers
| CAS Number | 369404-23-9 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)C)N3CC(=NN(C3=N2)CCO)C4=CC=C(C=C4)F |
| InChIKey | IXNOYAJPVIIQGB-UHFFFAOYSA-N |
Product Overview
AC1LD7FN (CAS 369404-23-9), with molecular formula C17H17FN6O3 and molecular weight 372.1346 g/mol. IUPAC: 3-(4-fluorophenyl)-1-(2-hydroxyethyl)-7,9-dimethyl-4H-purino[8,7-c][1,2,4]triazine-6,8-dione.