7-(3-hydroxypropyl)-1,3-dimethyl-8-[(piperidin-1-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
7-(3-hydroxypropyl)-1,3-dimethyl-8-[(piperidin-1-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione
7-(3-hydroxypropyl)-1,3-dimethyl-8-[(piperidin-1-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | C470-0598 |
| Compound Name: | 7-(3-hydroxypropyl)-1,3-dimethyl-8-[(piperidin-1-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 335.4 |
| Molecular Formula: | C16 H25 N5 O3 |
| Smiles: | CN1C(c2c(nc(CN3CCCCC3)n2CCCO)N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.6771 |
| logD: | 0.4597 |
| logSw: | -0.427 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.319 |
| InChI Key: | YLLQCZMLDPISGN-UHFFFAOYSA-N |