methyl (1-methyl-2,4-dioxo-8-phenyl-1,2,4,6,7,8-hexahydro-3H-imidazo[2,1-f]purin-3-yl)acetate
Chemical Structure Depiction of
methyl (1-methyl-2,4-dioxo-8-phenyl-1,2,4,6,7,8-hexahydro-3H-imidazo[2,1-f]purin-3-yl)acetate
methyl (1-methyl-2,4-dioxo-8-phenyl-1,2,4,6,7,8-hexahydro-3H-imidazo[2,1-f]purin-3-yl)acetate
Compound characteristics
| Compound ID: | E461-0322 |
| Compound Name: | methyl (1-methyl-2,4-dioxo-8-phenyl-1,2,4,6,7,8-hexahydro-3H-imidazo[2,1-f]purin-3-yl)acetate |
| Molecular Weight: | 355.35 |
| Molecular Formula: | C17 H17 N5 O4 |
| Smiles: | CN1C(N(CC(=O)OC)C(c2c1nc1N(CCn12)c1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5394 |
| logD: | 1.3117 |
| logSw: | -1.9638 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 65.999 |
| InChI Key: | GKNMCMOKOVXIGM-UHFFFAOYSA-N |