8-[(3,5-dimethylpiperidin-1-yl)methyl]-1,3-dimethyl-7-[(4-methylphenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
8-[(3,5-dimethylpiperidin-1-yl)methyl]-1,3-dimethyl-7-[(4-methylphenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione
8-[(3,5-dimethylpiperidin-1-yl)methyl]-1,3-dimethyl-7-[(4-methylphenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | C470-0320 |
| Compound Name: | 8-[(3,5-dimethylpiperidin-1-yl)methyl]-1,3-dimethyl-7-[(4-methylphenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 409.53 |
| Molecular Formula: | C23 H31 N5 O2 |
| Smiles: | CC1CC(C)CN(C1)Cc1nc2c(C(N(C)C(N2C)=O)=O)n1Cc1ccc(C)cc1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.0455 |
| logD: | 4.02 |
| logSw: | -3.9662 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.28 |
| InChI Key: | SJDZNNBNTXVLQR-UHFFFAOYSA-N |