3-(2-methylphenyl)-1-(2-methylpropyl)-7-propyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
3-(2-methylphenyl)-1-(2-methylpropyl)-7-propyl-3,7-dihydro-1H-purine-2,6-dione
3-(2-methylphenyl)-1-(2-methylpropyl)-7-propyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V012-5905 |
| Compound Name: | 3-(2-methylphenyl)-1-(2-methylpropyl)-7-propyl-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 340.42 |
| Molecular Formula: | C19 H24 N4 O2 |
| Salt: | not_available |
| Smiles: | CCCn1cnc2c1C(N(CC(C)C)C(N2c1ccccc1C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2648 |
| logD: | 3.2648 |
| logSw: | -3.3649 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.495 |
| InChI Key: | NBMORWHCRPRRQV-UHFFFAOYSA-N |