3-(4-chlorophenyl)-1-[(4-fluorophenyl)methyl]-7-[(4-methylphenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
3-(4-chlorophenyl)-1-[(4-fluorophenyl)methyl]-7-[(4-methylphenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione
3-(4-chlorophenyl)-1-[(4-fluorophenyl)methyl]-7-[(4-methylphenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V023-5206 |
| Compound Name: | 3-(4-chlorophenyl)-1-[(4-fluorophenyl)methyl]-7-[(4-methylphenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 474.92 |
| Molecular Formula: | C26 H20 Cl F N4 O2 |
| Salt: | not_available |
| Smiles: | Cc1ccc(Cn2cnc3c2C(N(Cc2ccc(cc2)F)C(N3c2ccc(cc2)[Cl])=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.9999 |
| logD: | 4.9999 |
| logSw: | -4.9771 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.275 |
| InChI Key: | CWCOIOQFVZLBLS-UHFFFAOYSA-N |