1-(2-phenoxyethyl)-7-(1-phenylethyl)-3-[4-(propan-2-yl)phenyl]-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
1-(2-phenoxyethyl)-7-(1-phenylethyl)-3-[4-(propan-2-yl)phenyl]-3,7-dihydro-1H-purine-2,6-dione
1-(2-phenoxyethyl)-7-(1-phenylethyl)-3-[4-(propan-2-yl)phenyl]-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V024-1462 |
| Compound Name: | 1-(2-phenoxyethyl)-7-(1-phenylethyl)-3-[4-(propan-2-yl)phenyl]-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 494.59 |
| Molecular Formula: | C30 H30 N4 O3 |
| Salt: | not_available |
| Smiles: | CC(C)c1ccc(cc1)N1C(N(CCOc2ccccc2)C(c2c1ncn2C(C)c1ccccc1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.1836 |
| logD: | 6.1836 |
| logSw: | -5.6232 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.082 |
| InChI Key: | NBTJKHDSBFQCLJ-QFIPXVFZSA-N |