ethyl [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
ethyl [8-(4-ethylphenyl)-1-methyl-2,4-dioxo-1,2,4,6,7,8-hexahydro-3H-imidazo[2,1-f]purin-3-yl]acetate
ethyl [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: | E461-0614 |
Compound Name: | ethyl [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: | 397.43 |
Molecular Formula: | C20 H23 N5 O4 |
Smiles: | CCc1ccc(cc1)N1CCn2c3C(N(CC(=O)OCC)C(N(C)c3nc12)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.1264 |
logD: | 2.8987 |
logSw: | -2.9929 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 65.579 |
InChI Key: | DDPBGADENURGJA-UHFFFAOYSA-N |