1-benzyl-3-(4-fluorophenyl)-7-(2-phenoxyethyl)-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
1-benzyl-3-(4-fluorophenyl)-7-(2-phenoxyethyl)-3,7-dihydro-1H-purine-2,6-dione
1-benzyl-3-(4-fluorophenyl)-7-(2-phenoxyethyl)-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V024-1441 |
| Compound Name: | 1-benzyl-3-(4-fluorophenyl)-7-(2-phenoxyethyl)-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 456.48 |
| Molecular Formula: | C26 H21 F N4 O3 |
| Salt: | not_available |
| Smiles: | C(c1ccccc1)N1C(c2c(ncn2CCOc2ccccc2)N(C1=O)c1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1176 |
| logD: | 4.1176 |
| logSw: | -4.2304 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 49.671 |
| InChI Key: | FZKJDASPVVELHW-UHFFFAOYSA-N |