7-[(4-fluorophenyl)methyl]-8-(2-methoxyphenoxy)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
7-[(4-fluorophenyl)methyl]-8-(2-methoxyphenoxy)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
7-[(4-fluorophenyl)methyl]-8-(2-methoxyphenoxy)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | 5339-0548 |
| Compound Name: | 7-[(4-fluorophenyl)methyl]-8-(2-methoxyphenoxy)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 410.4 |
| Molecular Formula: | C21 H19 F N4 O4 |
| Smiles: | CN1C(c2c(nc(n2Cc2ccc(cc2)F)Oc2ccccc2OC)N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9332 |
| logD: | 3.9332 |
| logSw: | -4.2249 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 57.47 |
| InChI Key: | BDRQEAWTOHAMJM-UHFFFAOYSA-N |