7-(2,3-dihydroxypropyl)-1-[2-(dimethylamino)ethyl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
7-(2,3-dihydroxypropyl)-1-[2-(dimethylamino)ethyl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
7-(2,3-dihydroxypropyl)-1-[2-(dimethylamino)ethyl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | D090-0128 |
| Compound Name: | 7-(2,3-dihydroxypropyl)-1-[2-(dimethylamino)ethyl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 311.34 |
| Molecular Formula: | C13 H21 N5 O4 |
| Smiles: | CN(C)CCN1C(c2c(ncn2CC(CO)O)N(C)C1=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | -1.5557 |
| logD: | -3.5275 |
| logSw: | -0.6124 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.045 |
| InChI Key: | OKWMTFYIQTVMIC-VIFPVBQESA-N |