3-methyl-8-[(morpholin-4-yl)methyl]-7-(3-phenylpropyl)-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
3-methyl-8-[(morpholin-4-yl)methyl]-7-(3-phenylpropyl)-3,7-dihydro-1H-purine-2,6-dione
3-methyl-8-[(morpholin-4-yl)methyl]-7-(3-phenylpropyl)-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | C692-0425 |
| Compound Name: | 3-methyl-8-[(morpholin-4-yl)methyl]-7-(3-phenylpropyl)-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 383.45 |
| Molecular Formula: | C20 H25 N5 O3 |
| Smiles: | CN1C(NC(c2c1nc(CN1CCOCC1)n2CCCc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9157 |
| logD: | 1.9098 |
| logSw: | -2.5463 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.214 |
| InChI Key: | XSOQPOYZIRUSRQ-UHFFFAOYSA-N |