7-benzyl-3-(4-fluorophenyl)-1-[(4-methoxyphenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
7-benzyl-3-(4-fluorophenyl)-1-[(4-methoxyphenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione
7-benzyl-3-(4-fluorophenyl)-1-[(4-methoxyphenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V024-0609 |
| Compound Name: | 7-benzyl-3-(4-fluorophenyl)-1-[(4-methoxyphenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 456.48 |
| Molecular Formula: | C26 H21 F N4 O3 |
| Salt: | not_available |
| Smiles: | COc1ccc(CN2C(c3c(ncn3Cc3ccccc3)N(C2=O)c2ccc(cc2)F)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.9642 |
| logD: | 3.9642 |
| logSw: | -4.1649 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 49.818 |
| InChI Key: | PZKHEBZJZFGIAW-UHFFFAOYSA-N |