8-[(2,6-dimethylmorpholin-4-yl)methyl]-7-[(4-fluorophenyl)methyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
8-[(2,6-dimethylmorpholin-4-yl)methyl]-7-[(4-fluorophenyl)methyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
8-[(2,6-dimethylmorpholin-4-yl)methyl]-7-[(4-fluorophenyl)methyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | C470-0130 |
| Compound Name: | 8-[(2,6-dimethylmorpholin-4-yl)methyl]-7-[(4-fluorophenyl)methyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 415.47 |
| Molecular Formula: | C21 H26 F N5 O3 |
| Smiles: | CC1CN(CC(C)O1)Cc1nc2c(C(N(C)C(N2C)=O)=O)n1Cc1ccc(cc1)F |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.0693 |
| logD: | 2.0692 |
| logSw: | -2.4681 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 54.346 |
| InChI Key: | ZLKNMMMQFFJDSU-UHFFFAOYSA-N |