2-(8-{[4-(4-methoxyphenyl)piperazin-1-yl]methyl}-3-methyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetamide
Chemical Structure Depiction of
2-(8-{[4-(4-methoxyphenyl)piperazin-1-yl]methyl}-3-methyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetamide
2-(8-{[4-(4-methoxyphenyl)piperazin-1-yl]methyl}-3-methyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetamide
Compound characteristics
| Compound ID: | C692-0568 |
| Compound Name: | 2-(8-{[4-(4-methoxyphenyl)piperazin-1-yl]methyl}-3-methyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetamide |
| Molecular Weight: | 427.46 |
| Molecular Formula: | C20 H25 N7 O4 |
| Smiles: | CN1C(NC(c2c1nc(CN1CCN(CC1)c1ccc(cc1)OC)n2CC(N)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.2492 |
| logD: | 0.246 |
| logSw: | -1.9438 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 100.79 |
| InChI Key: | ZQKPSCPJWGEQOR-UHFFFAOYSA-N |