methyl [8-(4-ethylphenyl)-1-methyl-2,4-dioxo-1,2,4,6,7,8-hexahydro-3H-imidazo[2,1-f]purin-3-yl]acetate
Chemical Structure Depiction of
methyl [8-(4-ethylphenyl)-1-methyl-2,4-dioxo-1,2,4,6,7,8-hexahydro-3H-imidazo[2,1-f]purin-3-yl]acetate
methyl [8-(4-ethylphenyl)-1-methyl-2,4-dioxo-1,2,4,6,7,8-hexahydro-3H-imidazo[2,1-f]purin-3-yl]acetate
Compound characteristics
| Compound ID: | E461-0613 |
| Compound Name: | methyl [8-(4-ethylphenyl)-1-methyl-2,4-dioxo-1,2,4,6,7,8-hexahydro-3H-imidazo[2,1-f]purin-3-yl]acetate |
| Molecular Weight: | 383.41 |
| Molecular Formula: | C19 H21 N5 O4 |
| Smiles: | CCc1ccc(cc1)N1CCn2c3C(N(CC(=O)OC)C(N(C)c3nc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5916 |
| logD: | 2.364 |
| logSw: | -2.7203 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 65.999 |
| InChI Key: | BIFMVNXQODCOBC-UHFFFAOYSA-N |