1-benzyl-3-(2-methylphenyl)-7-[(2-methylphenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
1-benzyl-3-(2-methylphenyl)-7-[(2-methylphenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione
1-benzyl-3-(2-methylphenyl)-7-[(2-methylphenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
Compound ID: | V024-0529 |
Compound Name: | 1-benzyl-3-(2-methylphenyl)-7-[(2-methylphenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione |
Molecular Weight: | 436.51 |
Molecular Formula: | C27 H24 N4 O2 |
Salt: | not_available |
Smiles: | Cc1ccccc1Cn1cnc2c1C(N(Cc1ccccc1)C(N2c1ccccc1C)=O)=O |
Stereo: | ACHIRAL |
logP: | 5.1641 |
logD: | 5.1641 |
logSw: | -5.0351 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 41.973 |
InChI Key: | QTHKKEMJZYHSHM-UHFFFAOYSA-N |