1-(2-phenoxyethyl)-7-(propan-2-yl)-3-[4-(propan-2-yl)phenyl]-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
1-(2-phenoxyethyl)-7-(propan-2-yl)-3-[4-(propan-2-yl)phenyl]-3,7-dihydro-1H-purine-2,6-dione
1-(2-phenoxyethyl)-7-(propan-2-yl)-3-[4-(propan-2-yl)phenyl]-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V024-1451 |
| Compound Name: | 1-(2-phenoxyethyl)-7-(propan-2-yl)-3-[4-(propan-2-yl)phenyl]-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 432.52 |
| Molecular Formula: | C25 H28 N4 O3 |
| Salt: | not_available |
| Smiles: | CC(C)c1ccc(cc1)N1C(N(CCOc2ccccc2)C(c2c1ncn2C(C)C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9473 |
| logD: | 4.9473 |
| logSw: | -4.4955 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.733 |
| InChI Key: | BUPHBYMNKOTNSC-UHFFFAOYSA-N |