3-(4-chlorophenyl)-1-[(4-fluorophenyl)methyl]-7-[(2-methylphenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
3-(4-chlorophenyl)-1-[(4-fluorophenyl)methyl]-7-[(2-methylphenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione
3-(4-chlorophenyl)-1-[(4-fluorophenyl)methyl]-7-[(2-methylphenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V029-5385 |
| Compound Name: | 3-(4-chlorophenyl)-1-[(4-fluorophenyl)methyl]-7-[(2-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: | Cc1ccccc1Cn1cnc2c1C(N(Cc1ccc(cc1)F)C(N2c1ccc(cc1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3597 |
| logD: | 5.3597 |
| logSw: | -5.8127 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.275 |
| InChI Key: | CTAYPJWLTPGWQO-UHFFFAOYSA-N |