3-(3-chlorophenyl)-7-[(3,4-dichlorophenyl)methyl]-1-[(4-fluorophenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
3-(3-chlorophenyl)-7-[(3,4-dichlorophenyl)methyl]-1-[(4-fluorophenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione
3-(3-chlorophenyl)-7-[(3,4-dichlorophenyl)methyl]-1-[(4-fluorophenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V029-7534 |
| Compound Name: | 3-(3-chlorophenyl)-7-[(3,4-dichlorophenyl)methyl]-1-[(4-fluorophenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 529.78 |
| Molecular Formula: | C25 H16 Cl3 F N4 O2 |
| Salt: | not_available |
| Smiles: | C(c1ccc(cc1)F)N1C(c2c(ncn2Cc2ccc(c(c2)[Cl])[Cl])N(C1=O)c1cccc(c1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.9384 |
| logD: | 5.9384 |
| logSw: | -6.3357 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.275 |
| InChI Key: | GWWGOKNEADLVPP-UHFFFAOYSA-N |