8-(4-fluorophenyl)-1-methyl-3-[(4-methylphenyl)methyl]-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Chemical Structure Depiction of
8-(4-fluorophenyl)-1-methyl-3-[(4-methylphenyl)methyl]-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
8-(4-fluorophenyl)-1-methyl-3-[(4-methylphenyl)methyl]-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Compound characteristics
Compound ID: | E461-0398 |
Compound Name: | 8-(4-fluorophenyl)-1-methyl-3-[(4-methylphenyl)methyl]-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione |
Molecular Weight: | 405.43 |
Molecular Formula: | C22 H20 F N5 O2 |
Smiles: | Cc1ccc(CN2C(c3c(nc4N(CCn34)c3ccc(cc3)F)N(C)C2=O)=O)cc1 |
Stereo: | ACHIRAL |
logP: | 4.2165 |
logD: | 3.7911 |
logSw: | -4.1691 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 45.149 |
InChI Key: | SHMCUHHSKLIZQA-UHFFFAOYSA-N |