7-[(4-tert-butylphenyl)methyl]-3-(2,4-difluorophenyl)-1-(propan-2-yl)-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
7-[(4-tert-butylphenyl)methyl]-3-(2,4-difluorophenyl)-1-(propan-2-yl)-3,7-dihydro-1H-purine-2,6-dione
7-[(4-tert-butylphenyl)methyl]-3-(2,4-difluorophenyl)-1-(propan-2-yl)-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V024-8254 |
| Compound Name: | 7-[(4-tert-butylphenyl)methyl]-3-(2,4-difluorophenyl)-1-(propan-2-yl)-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 452.5 |
| Molecular Formula: | C25 H26 F2 N4 O2 |
| Salt: | not_available |
| Smiles: | CC(C)N1C(c2c(ncn2Cc2ccc(cc2)C(C)(C)C)N(C1=O)c1ccc(cc1F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8863 |
| logD: | 4.8863 |
| logSw: | -4.6738 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 41.966 |
| InChI Key: | IGXXGGPORJBVIQ-UHFFFAOYSA-N |