3-(2-chlorophenyl)-7-[(3-fluorophenyl)methyl]-1-(2-methoxyethyl)-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
3-(2-chlorophenyl)-7-[(3-fluorophenyl)methyl]-1-(2-methoxyethyl)-3,7-dihydro-1H-purine-2,6-dione
3-(2-chlorophenyl)-7-[(3-fluorophenyl)methyl]-1-(2-methoxyethyl)-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V018-1983 |
| Compound Name: | 3-(2-chlorophenyl)-7-[(3-fluorophenyl)methyl]-1-(2-methoxyethyl)-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 428.85 |
| Molecular Formula: | C21 H18 Cl F N4 O3 |
| Smiles: | COCCN1C(c2c(ncn2Cc2cccc(c2)F)N(C1=O)c1ccccc1[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 2.8373 |
| logD: | 2.8373 |
| logSw: | -3.3199 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.566 |
| InChI Key: | AIECNBVKDXUVLJ-UHFFFAOYSA-N |