8-[(2-hydroxyethyl)amino]-7-[2-hydroxy-3-(2-methylphenoxy)propyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
8-[(2-hydroxyethyl)amino]-7-[2-hydroxy-3-(2-methylphenoxy)propyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
8-[(2-hydroxyethyl)amino]-7-[2-hydroxy-3-(2-methylphenoxy)propyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | 4550-0070 |
| Compound Name: | 8-[(2-hydroxyethyl)amino]-7-[2-hydroxy-3-(2-methylphenoxy)propyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 403.44 |
| Molecular Formula: | C19 H25 N5 O5 |
| Smiles: | Cc1ccccc1OCC(Cn1c2C(N(C)C(N(C)c2nc1NCCO)=O)=O)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.959 |
| logD: | 1.959 |
| logSw: | -2.2368 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 95.82 |
| InChI Key: | VSMNVLXTEQOVTB-ZDUSSCGKSA-N |