1,3-dimethyl-8-[(4-methylpiperazin-1-yl)methyl]-7-(3-oxobutan-2-yl)-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
1,3-dimethyl-8-[(4-methylpiperazin-1-yl)methyl]-7-(3-oxobutan-2-yl)-3,7-dihydro-1H-purine-2,6-dione
1,3-dimethyl-8-[(4-methylpiperazin-1-yl)methyl]-7-(3-oxobutan-2-yl)-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | 7741-1592 |
| Compound Name: | 1,3-dimethyl-8-[(4-methylpiperazin-1-yl)methyl]-7-(3-oxobutan-2-yl)-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 362.43 |
| Molecular Formula: | C17 H26 N6 O3 |
| Smiles: | CC(C(C)=O)n1c2C(N(C)C(N(C)c2nc1CN1CCN(C)CC1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | -0.0672 |
| logD: | -1.0382 |
| logSw: | 0.1281 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 65.684 |
| InChI Key: | VGRIBGPUIOINRT-NSHDSACASA-N |