7-[(4-tert-butylphenyl)methyl]-3-(4-fluorophenyl)-1-[(2-fluorophenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
7-[(4-tert-butylphenyl)methyl]-3-(4-fluorophenyl)-1-[(2-fluorophenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione
7-[(4-tert-butylphenyl)methyl]-3-(4-fluorophenyl)-1-[(2-fluorophenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V024-1803 |
| Compound Name: | 7-[(4-tert-butylphenyl)methyl]-3-(4-fluorophenyl)-1-[(2-fluorophenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 500.55 |
| Molecular Formula: | C29 H26 F2 N4 O2 |
| Salt: | not_available |
| Smiles: | CC(C)(C)c1ccc(Cn2cnc3c2C(N(Cc2ccccc2F)C(N3c2ccc(cc2)F)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.9167 |
| logD: | 5.9167 |
| logSw: | -5.6463 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.275 |
| InChI Key: | UVTZYPDJICVMSZ-UHFFFAOYSA-N |