8-[(3-hydroxypropyl)amino]-3-methyl-7-(3-phenylpropyl)-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
8-[(3-hydroxypropyl)amino]-3-methyl-7-(3-phenylpropyl)-3,7-dihydro-1H-purine-2,6-dione
8-[(3-hydroxypropyl)amino]-3-methyl-7-(3-phenylpropyl)-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | 4236-0934 |
| Compound Name: | 8-[(3-hydroxypropyl)amino]-3-methyl-7-(3-phenylpropyl)-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 357.41 |
| Molecular Formula: | C18 H23 N5 O3 |
| Smiles: | CN1C(NC(c2c1nc(NCCCO)n2CCCc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8469 |
| logD: | 1.8467 |
| logSw: | -2.0822 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 80.507 |
| InChI Key: | JIOQFGLCEPFQHB-UHFFFAOYSA-N |