8-[4-(4-methoxyphenyl)piperazin-1-yl]-3-methyl-7-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
8-[4-(4-methoxyphenyl)piperazin-1-yl]-3-methyl-7-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione
8-[4-(4-methoxyphenyl)piperazin-1-yl]-3-methyl-7-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | 4554-6851 |
| Compound Name: | 8-[4-(4-methoxyphenyl)piperazin-1-yl]-3-methyl-7-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 396.45 |
| Molecular Formula: | C20 H24 N6 O3 |
| Smiles: | CN1C(NC(c2c1nc(N1CCN(CC1)c1ccc(cc1)OC)n2CC=C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9106 |
| logD: | 2.9101 |
| logSw: | -3.385 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.665 |
| InChI Key: | XCYBRDXOUXNTHZ-UHFFFAOYSA-N |