1,3-dimethyl-8-[(3-methylpiperidin-1-yl)methyl]-7-(3-phenylpropyl)-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
1,3-dimethyl-8-[(3-methylpiperidin-1-yl)methyl]-7-(3-phenylpropyl)-3,7-dihydro-1H-purine-2,6-dione
1,3-dimethyl-8-[(3-methylpiperidin-1-yl)methyl]-7-(3-phenylpropyl)-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | C470-0724 |
| Compound Name: | 1,3-dimethyl-8-[(3-methylpiperidin-1-yl)methyl]-7-(3-phenylpropyl)-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 409.53 |
| Molecular Formula: | C23 H31 N5 O2 |
| Smiles: | CC1CCCN(C1)Cc1nc2c(C(N(C)C(N2C)=O)=O)n1CCCc1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7003 |
| logD: | 3.4924 |
| logSw: | -3.8336 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.325 |
| InChI Key: | JDULCTZIBSYMEN-KRWDZBQOSA-N |