7-heptyl-1,3-dimethyl-8-[(3-methylpiperidin-1-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
7-heptyl-1,3-dimethyl-8-[(3-methylpiperidin-1-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione
7-heptyl-1,3-dimethyl-8-[(3-methylpiperidin-1-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | C470-0699 |
| Compound Name: | 7-heptyl-1,3-dimethyl-8-[(3-methylpiperidin-1-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 389.54 |
| Molecular Formula: | C21 H35 N5 O2 |
| Smiles: | CCCCCCCn1c2C(N(C)C(N(C)c2nc1CN1CCCC(C)C1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3623 |
| logD: | 4.1544 |
| logSw: | -4.0559 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.596 |
| InChI Key: | KRFFPLIJQXJNPV-INIZCTEOSA-N |