7-(3,3-dimethyl-2-oxobutyl)-1-(2-phenoxyethyl)-3-[4-(propan-2-yl)phenyl]-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
7-(3,3-dimethyl-2-oxobutyl)-1-(2-phenoxyethyl)-3-[4-(propan-2-yl)phenyl]-3,7-dihydro-1H-purine-2,6-dione
7-(3,3-dimethyl-2-oxobutyl)-1-(2-phenoxyethyl)-3-[4-(propan-2-yl)phenyl]-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V024-1510 |
| Compound Name: | 7-(3,3-dimethyl-2-oxobutyl)-1-(2-phenoxyethyl)-3-[4-(propan-2-yl)phenyl]-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 488.59 |
| Molecular Formula: | C28 H32 N4 O4 |
| Salt: | not_available |
| Smiles: | CC(C)c1ccc(cc1)N1C(N(CCOc2ccccc2)C(c2c1ncn2CC(C(C)(C)C)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8404 |
| logD: | 4.8404 |
| logSw: | -4.5074 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 63.189 |
| InChI Key: | MULHPGNXPGRFER-UHFFFAOYSA-N |