7-[(2-chlorophenyl)methyl]-3-(3-fluorophenyl)-1-(2-methoxyethyl)-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
7-[(2-chlorophenyl)methyl]-3-(3-fluorophenyl)-1-(2-methoxyethyl)-3,7-dihydro-1H-purine-2,6-dione
7-[(2-chlorophenyl)methyl]-3-(3-fluorophenyl)-1-(2-methoxyethyl)-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V016-7133 |
| Compound Name: | 7-[(2-chlorophenyl)methyl]-3-(3-fluorophenyl)-1-(2-methoxyethyl)-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 428.85 |
| Molecular Formula: | C21 H18 Cl F N4 O3 |
| Salt: | not_available |
| Smiles: | COCCN1C(c2c(ncn2Cc2ccccc2[Cl])N(C1=O)c1cccc(c1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9506 |
| logD: | 2.9506 |
| logSw: | -3.2486 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.867 |
| InChI Key: | HMEYTLWJIJSEBT-UHFFFAOYSA-N |