1-(2-phenoxyethyl)-3-[4-(propan-2-yl)phenyl]-7-propyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
1-(2-phenoxyethyl)-3-[4-(propan-2-yl)phenyl]-7-propyl-3,7-dihydro-1H-purine-2,6-dione
1-(2-phenoxyethyl)-3-[4-(propan-2-yl)phenyl]-7-propyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V024-1439 |
| Compound Name: | 1-(2-phenoxyethyl)-3-[4-(propan-2-yl)phenyl]-7-propyl-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 432.52 |
| Molecular Formula: | C25 H28 N4 O3 |
| Salt: | not_available |
| Smiles: | CCCn1cnc2c1C(N(CCOc1ccccc1)C(N2c1ccc(cc1)C(C)C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.616 |
| logD: | 4.616 |
| logSw: | -4.2024 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 49.921 |
| InChI Key: | IESCJIWBVIIWGS-UHFFFAOYSA-N |