1,3-dimethyl-7-(3-methylbutyl)-8-[(2-methylpiperidin-1-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
1,3-dimethyl-7-(3-methylbutyl)-8-[(2-methylpiperidin-1-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione
1,3-dimethyl-7-(3-methylbutyl)-8-[(2-methylpiperidin-1-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | C470-0648 |
| Compound Name: | 1,3-dimethyl-7-(3-methylbutyl)-8-[(2-methylpiperidin-1-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 361.49 |
| Molecular Formula: | C19 H31 N5 O2 |
| Smiles: | CC(C)CCn1c2C(N(C)C(N(C)c2nc1CN1CCCCC1C)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.107 |
| logD: | 2.7719 |
| logSw: | -3.0477 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.114 |
| InChI Key: | RDVAOCACCGVCAO-AWEZNQCLSA-N |