8-[(3-hydroxypropyl)amino]-3-methyl-7-(2-phenoxyethyl)-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
8-[(3-hydroxypropyl)amino]-3-methyl-7-(2-phenoxyethyl)-3,7-dihydro-1H-purine-2,6-dione
8-[(3-hydroxypropyl)amino]-3-methyl-7-(2-phenoxyethyl)-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | 5228-1408 |
| Compound Name: | 8-[(3-hydroxypropyl)amino]-3-methyl-7-(2-phenoxyethyl)-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 359.38 |
| Molecular Formula: | C17 H21 N5 O4 |
| Smiles: | CN1C(NC(c2c1nc(NCCCO)n2CCOc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3719 |
| logD: | 1.3717 |
| logSw: | -1.8328 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 87.925 |
| InChI Key: | JWRJLEVTIFNKNR-UHFFFAOYSA-N |