8-(benzylamino)-1,3-dimethyl-7-[(2-methylphenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
8-(benzylamino)-1,3-dimethyl-7-[(2-methylphenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione
8-(benzylamino)-1,3-dimethyl-7-[(2-methylphenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | 3238-0266 |
| Compound Name: | 8-(benzylamino)-1,3-dimethyl-7-[(2-methylphenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 389.46 |
| Molecular Formula: | C22 H23 N5 O2 |
| Smiles: | Cc1ccccc1Cn1c2C(N(C)C(N(C)c2nc1NCc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.321 |
| logD: | 4.319 |
| logSw: | -4.279 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.846 |
| InChI Key: | LGHCQZLRRIUWDX-UHFFFAOYSA-N |