7-[3-(2,4-dichlorophenoxy)-2-hydroxypropyl]-8-{[2-(dimethylamino)ethyl]amino}-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
7-[3-(2,4-dichlorophenoxy)-2-hydroxypropyl]-8-{[2-(dimethylamino)ethyl]amino}-3-methyl-3,7-dihydro-1H-purine-2,6-dione
7-[3-(2,4-dichlorophenoxy)-2-hydroxypropyl]-8-{[2-(dimethylamino)ethyl]amino}-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | 3346-2621 |
| Compound Name: | 7-[3-(2,4-dichlorophenoxy)-2-hydroxypropyl]-8-{[2-(dimethylamino)ethyl]amino}-3-methyl-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 471.34 |
| Molecular Formula: | C19 H24 Cl2 N6 O4 |
| Smiles: | CN(C)CCNc1nc2c(C(NC(N2C)=O)=O)n1CC(COc1ccc(cc1[Cl])[Cl])O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6246 |
| logD: | -0.1431 |
| logSw: | -3.3779 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 91.944 |
| InChI Key: | ZYQJAAIPIQIGKK-LBPRGKRZSA-N |