1,3-dimethyl-8-(piperidin-1-yl)-7-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
1,3-dimethyl-8-(piperidin-1-yl)-7-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione
1,3-dimethyl-8-(piperidin-1-yl)-7-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | D226-0047 |
| Compound Name: | 1,3-dimethyl-8-(piperidin-1-yl)-7-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 303.36 |
| Molecular Formula: | C15 H21 N5 O2 |
| Smiles: | CN1C(c2c(nc(N3CCCCC3)n2CC=C)N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5869 |
| logD: | 2.5868 |
| logSw: | -2.4624 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 45.947 |
| InChI Key: | IRDWVTNSSIPXHK-UHFFFAOYSA-N |