7-(2-aminoethyl)-1,3-dimethyl-8-(piperidin-1-yl)-3,7-dihydro-1H-purine-2,6-dione--hydrogen chloride (1/1)
Chemical Structure Depiction of
7-(2-aminoethyl)-1,3-dimethyl-8-(piperidin-1-yl)-3,7-dihydro-1H-purine-2,6-dione--hydrogen chloride (1/1)
7-(2-aminoethyl)-1,3-dimethyl-8-(piperidin-1-yl)-3,7-dihydro-1H-purine-2,6-dione--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 8012-0524 |
| Compound Name: | 7-(2-aminoethyl)-1,3-dimethyl-8-(piperidin-1-yl)-3,7-dihydro-1H-purine-2,6-dione--hydrogen chloride (1/1) |
| Molecular Weight: | 342.83 |
| Molecular Formula: | C14 H22 N6 O2 |
| Salt: | HCl |
| Smiles: | CN1C(c2c(nc(N3CCCCC3)n2CCN)N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.0298 |
| logD: | -2.1757 |
| logSw: | -0.9862 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.103 |
| InChI Key: | IVIYTYIOTWHOBS-UHFFFAOYSA-N |