7-[(4-bromophenyl)methyl]-8-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
7-[(4-bromophenyl)methyl]-8-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
7-[(4-bromophenyl)methyl]-8-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | C470-0154 |
| Compound Name: | 7-[(4-bromophenyl)methyl]-8-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 476.37 |
| Molecular Formula: | C21 H26 Br N5 O3 |
| Smiles: | CC1CN(CC(C)O1)Cc1nc2c(C(N(C)C(N2C)=O)=O)n1Cc1ccc(cc1)[Br] |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.8742 |
| logD: | 2.8741 |
| logSw: | -3.0078 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 54.346 |
| InChI Key: | OUUANKGJOCSFOK-UHFFFAOYSA-N |