1,3-dimethyl-8-(piperazin-1-yl)-7-(propan-2-yl)-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
1,3-dimethyl-8-(piperazin-1-yl)-7-(propan-2-yl)-3,7-dihydro-1H-purine-2,6-dione
1,3-dimethyl-8-(piperazin-1-yl)-7-(propan-2-yl)-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | Y600-2043 |
| Compound Name: | 1,3-dimethyl-8-(piperazin-1-yl)-7-(propan-2-yl)-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 306.37 |
| Molecular Formula: | C14 H22 N6 O2 |
| Smiles: | CC(C)n1c2C(N(C)C(N(C)c2nc1N1CCNCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.9299 |
| logD: | -1.5399 |
| logSw: | -1.3959 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.005 |
| InChI Key: | CHMCPTIFMYDEOT-UHFFFAOYSA-N |