7-[2-(3,4-difluorophenyl)-2-oxoethyl]-1-(2-methoxyethyl)-3-(2-methoxyphenyl)-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
7-[2-(3,4-difluorophenyl)-2-oxoethyl]-1-(2-methoxyethyl)-3-(2-methoxyphenyl)-3,7-dihydro-1H-purine-2,6-dione
7-[2-(3,4-difluorophenyl)-2-oxoethyl]-1-(2-methoxyethyl)-3-(2-methoxyphenyl)-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V028-7251 |
| Compound Name: | 7-[2-(3,4-difluorophenyl)-2-oxoethyl]-1-(2-methoxyethyl)-3-(2-methoxyphenyl)-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 470.43 |
| Molecular Formula: | C23 H20 F2 N4 O5 |
| Salt: | not_available |
| Smiles: | COCCN1C(c2c(ncn2CC(c2ccc(c(c2)F)F)=O)N(C1=O)c1ccccc1OC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1972 |
| logD: | 2.1972 |
| logSw: | -2.6794 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 71.443 |
| InChI Key: | NMKPQGBFKOSDCD-UHFFFAOYSA-N |