7-butyl-8-[(3,5-dimethylpiperidin-1-yl)methyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
7-butyl-8-[(3,5-dimethylpiperidin-1-yl)methyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
7-butyl-8-[(3,5-dimethylpiperidin-1-yl)methyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | C470-0056 |
| Compound Name: | 7-butyl-8-[(3,5-dimethylpiperidin-1-yl)methyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 361.49 |
| Molecular Formula: | C19 H31 N5 O2 |
| Smiles: | CCCCn1c2C(N(C)C(N(C)c2nc1CN1CC(C)CC(C)C1)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.3336 |
| logD: | 3.1349 |
| logSw: | -3.5077 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.53 |
| InChI Key: | GBSIJVCCMKWTAN-UHFFFAOYSA-N |