3-(4-chlorophenyl)-7-[(2,6-difluorophenyl)methyl]-1-(2-methoxyethyl)-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
3-(4-chlorophenyl)-7-[(2,6-difluorophenyl)methyl]-1-(2-methoxyethyl)-3,7-dihydro-1H-purine-2,6-dione
3-(4-chlorophenyl)-7-[(2,6-difluorophenyl)methyl]-1-(2-methoxyethyl)-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V017-2701 |
| Compound Name: | 3-(4-chlorophenyl)-7-[(2,6-difluorophenyl)methyl]-1-(2-methoxyethyl)-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 446.84 |
| Molecular Formula: | C21 H17 Cl F2 N4 O3 |
| Salt: | not_available |
| Smiles: | COCCN1C(c2c(ncn2Cc2c(cccc2F)F)N(C1=O)c1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 2.9618 |
| logD: | 2.9618 |
| logSw: | -3.3893 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.867 |
| InChI Key: | IWKMYWJZAKFVKK-UHFFFAOYSA-N |