3-[2-(diethylamino)ethyl]-1-methyl-3,7-dihydro-1H-purine-2,6-dione--hydrogen chloride (1/1)
Chemical Structure Depiction of
3-[2-(diethylamino)ethyl]-1-methyl-3,7-dihydro-1H-purine-2,6-dione--hydrogen chloride (1/1)
3-[2-(diethylamino)ethyl]-1-methyl-3,7-dihydro-1H-purine-2,6-dione--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D090-0131 |
| Compound Name: | 3-[2-(diethylamino)ethyl]-1-methyl-3,7-dihydro-1H-purine-2,6-dione--hydrogen chloride (1/1) |
| Molecular Weight: | 301.77 |
| Molecular Formula: | C12 H19 N5 O2 |
| Salt: | HCl |
| Smiles: | CCN(CC)CCN1C(N(C)C(c2c1nc[nH]2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.864 |
| logD: | -2.078 |
| logSw: | -1.6152 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.938 |
| InChI Key: | GNAKURVGRYCMKS-UHFFFAOYSA-N |