8-[(2-ethylpiperidin-1-yl)methyl]-7-hexyl-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
8-[(2-ethylpiperidin-1-yl)methyl]-7-hexyl-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
8-[(2-ethylpiperidin-1-yl)methyl]-7-hexyl-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | C470-0676 |
| Compound Name: | 8-[(2-ethylpiperidin-1-yl)methyl]-7-hexyl-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 389.54 |
| Molecular Formula: | C21 H35 N5 O2 |
| Smiles: | CCCCCCn1c2C(N(C)C(N(C)c2nc1CN1CCCCC1CC)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2764 |
| logD: | 3.9312 |
| logSw: | -4.1754 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.475 |
| InChI Key: | RDOFFCDFDMKXHS-INIZCTEOSA-N |