7-[(2,4-difluorophenyl)methyl]-1-ethyl-3-(3-methoxyphenyl)-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
7-[(2,4-difluorophenyl)methyl]-1-ethyl-3-(3-methoxyphenyl)-3,7-dihydro-1H-purine-2,6-dione
7-[(2,4-difluorophenyl)methyl]-1-ethyl-3-(3-methoxyphenyl)-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V020-6430 |
| Compound Name: | 7-[(2,4-difluorophenyl)methyl]-1-ethyl-3-(3-methoxyphenyl)-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 412.39 |
| Molecular Formula: | C21 H18 F2 N4 O3 |
| Salt: | not_available |
| Smiles: | CCN1C(c2c(ncn2Cc2ccc(cc2F)F)N(C1=O)c1cccc(c1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.188 |
| logD: | 3.188 |
| logSw: | -3.1874 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 49.814 |
| InChI Key: | KZBOOVNHFJPTHC-UHFFFAOYSA-N |