7-ethyl-1-(2-phenoxyethyl)-3-[4-(propan-2-yl)phenyl]-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
7-ethyl-1-(2-phenoxyethyl)-3-[4-(propan-2-yl)phenyl]-3,7-dihydro-1H-purine-2,6-dione
7-ethyl-1-(2-phenoxyethyl)-3-[4-(propan-2-yl)phenyl]-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V024-1449 |
| Compound Name: | 7-ethyl-1-(2-phenoxyethyl)-3-[4-(propan-2-yl)phenyl]-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 418.49 |
| Molecular Formula: | C24 H26 N4 O3 |
| Salt: | not_available |
| Smiles: | CCn1cnc2c1C(N(CCOc1ccccc1)C(N2c1ccc(cc1)C(C)C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1876 |
| logD: | 4.1876 |
| logSw: | -4.0021 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 49.667 |
| InChI Key: | KQXNACZAJMILBV-UHFFFAOYSA-N |