2-(8-{[4-(2-fluorophenyl)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-(2-fluorophenyl)piperazin-1-yl]methyl}-3-methyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetamide
2-(8-{[4-(2-fluorophenyl)piperazin-1-yl]methyl}-3-methyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetamide
Compound characteristics
| Compound ID: | C692-0566 |
| Compound Name: | 2-(8-{[4-(2-fluorophenyl)piperazin-1-yl]methyl}-3-methyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetamide |
| Molecular Weight: | 415.43 |
| Molecular Formula: | C19 H22 F N7 O3 |
| Smiles: | CN1C(NC(c2c1nc(CN1CCN(CC1)c1ccccc1F)n2CC(N)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.3238 |
| logD: | 0.3208 |
| logSw: | -2.0021 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 92.946 |
| InChI Key: | RAADLIUQZXRFFK-UHFFFAOYSA-N |