7-[2-hydroxy-3-(3-methylphenoxy)propyl]-3-methyl-8-[(2-methylpropyl)amino]-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
7-[2-hydroxy-3-(3-methylphenoxy)propyl]-3-methyl-8-[(2-methylpropyl)amino]-3,7-dihydro-1H-purine-2,6-dione
7-[2-hydroxy-3-(3-methylphenoxy)propyl]-3-methyl-8-[(2-methylpropyl)amino]-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | 7706-0434 |
| Compound Name: | 7-[2-hydroxy-3-(3-methylphenoxy)propyl]-3-methyl-8-[(2-methylpropyl)amino]-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 401.46 |
| Molecular Formula: | C20 H27 N5 O4 |
| Smiles: | CC(C)CNc1nc2c(C(NC(N2C)=O)=O)n1CC(COc1cccc(C)c1)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3248 |
| logD: | 3.3246 |
| logSw: | -3.4009 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 88.15 |
| InChI Key: | NOXPFJLIWFOFBH-AWEZNQCLSA-N |