1,3-dimethyl-7-(2-methylprop-2-en-1-yl)-8-(piperidin-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
1,3-dimethyl-7-(2-methylprop-2-en-1-yl)-8-(piperidin-1-yl)-3,7-dihydro-1H-purine-2,6-dione
1,3-dimethyl-7-(2-methylprop-2-en-1-yl)-8-(piperidin-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | D226-0044 |
| Compound Name: | 1,3-dimethyl-7-(2-methylprop-2-en-1-yl)-8-(piperidin-1-yl)-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 317.39 |
| Molecular Formula: | C16 H23 N5 O2 |
| Smiles: | CC(=C)Cn1c2C(N(C)C(N(C)c2nc1N1CCCCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1654 |
| logD: | 3.1653 |
| logSw: | -2.859 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 45.969 |
| InChI Key: | FIKVDSYHDCXTJL-UHFFFAOYSA-N |